Milrinone
CAS Number: 78415-72-2
Molecular Mass: 211.22 g/mol
Formula: C12H9N3O
Smiles: Cc1[nH]c(=O)c(C#N)cc1-c1ccncc1
Synonymes:
Milrinone, milrinone, 78415-72-2, Milrila, Milrinona, Milrinonum, Win-47203-2, 1,6-Dihydro-2-methyl-6-oxo(3,4'-bipyridine)-5-carbonitrile, 6-methyl-2-oxo-5-(pyridin-4-yl)-1,2-dihydropyridine-3-carbonitrile, JU9YAX04C7, WIN 47203, NSC-760072, DTXSID5023324, WIN 47,203-2, (3,4'-BIPYRIDINE)-5-CARBONITRILE, 1,6-DIHYDRO-2-METHYL-6-OXO-, DTXCID103324, Corotrop, CHEBI:50693, (3,4'-Bipyridine)-5-carbonitrile, 6-dihydro-2-methyl-6-oxo-, [3,4'-Bipyridine]-5-carbonitrile, 1,6-dihydro-2-methyl-6-oxo-, Lactate, Milrinone, RefChem:57100, Win47203, C01CE02, 278-903-6, Primacor, Corotrope, 6-methyl-2-oxo-5-pyridin-4-yl-1H-pyridine-3-carbonitrile, 2-methyl-6-oxo-1,6-dihydro-[3,4'-bipyridine]-5-carbonitrile, MFCD00133539, 3-Cyano-6-methyl-5-(4-pyridyl)-2-pyridone, 1,6-Dihydro-2-methyl-6-oxo-(3,4'-bipyridine)-5-carbonitrile, CHEMBL189, 6-Methyl-5-(4-pyridyl)-2-pyridone-3-carbonitrile, 2-methyl-6-oxo-1,6-dihydro-3,4'-bipyridine-5-carbonitrile, Milrinonum [Latin], NCGC00015675-08, NCGC00164390-01, Milrinona [Spanish], 1,6-Dihydro-2-methyl-6-oxo-[3,4'-bipyridine]-5-carbonitrile, CAS-78415-72-2, 2-Methyl-6-oxo-1,6-dihydro-3,4'-bipyridine-5-carbonitrile (Milrinone), 2-Methyl-6-oxo-1,6-dihydro-[3,4']bipyridinyl-5-carbonitrile, YM 018, SMR000058475, Milrila (TN), WIN 47203-2, CCRIS 3795, SR-01000075524, EINECS 278-903-6, UNII-JU9YAX04C7, BRN 3546821, Milrinone?, Milrinone [USAN:USP:INN:BAN], Milrinone (Primacor), Milrinone (Standard), Tocris-1504, 111GE027, MILRINONE [INN], MILRINONE [JAN], MILRINONE [MI], MILRINONE [USAN], 1,2-DIHYDRO-6-METHYL-2-OXO-5-(4-PYRIDINYL)NICOTINONITRILE, Prestwick0_001065, Prestwick1_001065, Prestwick2_001065, Prestwick3_001065, Lopac-M-4659, MILRINONE [VANDF], M1663, MILRINONE [MART.], M 4659, MILRINONE [USP-RS], MILRINONE [WHO-DD], Milrinone (JAN/USP/INN), Lopac0_000737, SCHEMBL36947, BSPBio_001050, MLS000028818, MLS001424052, MLS006011946, BIDD:GT0197, Milrinone - Bio-X trade mark, SPBio_002965, BPBio1_001156, GTPL5225, orb1309788, SCHEMBL8309385, BDBM15296, 2-hydroxy-6-methyl-5-pyridin-4-ylpyridine-3-carbonitrile, 6-methyl-2-oxo-5-(4-pyridyl)-1H-pyridine-3-carbonitrile, MILRINONE [USP MONOGRAPH], GLXC-06520, HMS1571E12, HMS2051L10, HMS2090J14, HMS2098E12, HMS2234A23, HMS3262C16, HMS3267P12, HMS3370H18, HMS3393L10, HMS3656G06, HMS3715E12, HMS3742G09, HMS5081C11, Pharmakon1600-01505489, Tox21_112113, Tox21_400069, Tox21_500737, EBC-08195, HY-14252R, Milrinone, >=97% (TLC), powder, NSC760072, s2484, SBB055743, AKOS015836135, Tox21_112113_1, AC-4730, CCG-101020, CCG-204822, CS-1367, DB00235, FM26007, KS-1440, LP00737, NC00270, NSC 760072, SDCCGSBI-0050715.P002, NCGC00015675-01, NCGC00015675-02, NCGC00015675-03, NCGC00015675-04, NCGC00015675-05, NCGC00015675-06, NCGC00015675-07, NCGC00015675-09, NCGC00015675-11, NCGC00015675-24, NCGC00025189-01, NCGC00025189-02, NCGC00025189-03, NCGC00261422-01, BM164671, HY-14252, SMR004703527, SY028050, AB00514027, EU-0100737, NS00007740, SW197308-3, T1096, C07224, D00417, EN300-117244, AB00514027-02, AB00514027-03, AB00514027_04, AB00514027_05, AB00597139-08, F036508, Q847399, SR-01000075524-1, SR-01000075524-3, SR-01000075524-4, SR-01000075524-6, BRD-K67080878-001-05-5, BRD-K67080878-001-15-4, BRD-K67080878-001-16-2, Z1501480412, 6-methyl-2-oxo-5-(4-pyridyl)hydropyridine-3-carbonitrile, 1,2-dihydro-6-methyl-2-oxo-5-(4 -pyridinyl)nicotinonitrile, 2-Methyl-6-oxo-1,6-dihydro[3,4'-bipyridine]-5-carbonitrile, Milrinone, United States Pharmacopeia (USP) Reference Standard, 1,2-DIHYDRO-6-METHYL-2-OXO-5-(4-PYRIDINYL)-NICOTINONITRILE, 1,6-Dihydro-2-methyl-6-oxo-(3,4 inverted exclamation mark -bipyridine)-5-carbonitrile
Bioactivity: -
Solubility in Different Solvents
| Solvent | Temperature [K] | Crystal form | Solubility [mg/mL] | Reference |
|---|---|---|---|---|
| Dimethylformamide | 278.15 | - | 0.2212 | [323] |
| Dimethylformamide | 283.15 | - | 0.255 | [323] |
| Dimethylformamide | 288.15 | - | 0.3004 | [323] |
| Dimethylformamide | 293.15 | - | 0.3543 | [323] |
| Dimethylformamide | 298.15 | - | 0.4078 | [323] |
| Dimethylformamide | 303.15 | - | 0.4703 | [323] |
| Dimethylformamide | 308.15 | - | 0.5382 | [323] |
| Dimethylformamide | 313.15 | - | 0.6052 | [323] |
| Dimethylformamide | 318.15 | - | 0.6719 | [323] |
| Dimethylformamide | 323.15 | - | 0.7582 | [323] |
| Ethanol | 278.15 | - | 0.034 | [323] |
| Ethanol | 283.15 | - | 0.0415 | [323] |
| Ethanol | 288.15 | - | 0.049 | [323] |
| Ethanol | 293.15 | - | 0.0573 | [323] |
| Ethanol | 298.15 | - | 0.0663 | [323] |
| Ethanol | 303.15 | - | 0.0764 | [323] |
| Ethanol | 308.15 | - | 0.0864 | [323] |
| Ethanol | 313.15 | - | 0.0971 | [323] |
| Ethanol | 318.15 | - | 0.109 | [323] |
| Ethanol | 323.15 | - | 0.1224 | [323] |
| Ethylene Glycol | 278.15 | - | 0.0659 | [323] |
| Ethylene Glycol | 283.15 | - | 0.07968 | [323] |
| Ethylene Glycol | 288.15 | - | 0.0934 | [323] |
| Ethylene Glycol | 293.15 | - | 0.1095 | [323] |
| Ethylene Glycol | 298.15 | - | 0.1272 | [323] |
| Ethylene Glycol | 303.15 | - | 0.1463 | [323] |
| Ethylene Glycol | 308.15 | - | 0.1653 | [323] |
| Ethylene Glycol | 313.15 | - | 0.1883 | [323] |
| Ethylene Glycol | 318.15 | - | 0.211 | [323] |
| Ethylene Glycol | 323.15 | - | 0.2394 | [323] |
| Isopropanol | 278.15 | - | 0.0686 | [323] |
| Isopropanol | 283.15 | - | 0.0807 | [323] |
| Isopropanol | 288.15 | - | 0.0953 | [323] |
| Isopropanol | 293.15 | - | 0.1114 | [323] |
| Isopropanol | 298.15 | - | 0.1299 | [323] |
| Isopropanol | 303.15 | - | 0.1474 | [323] |
| Isopropanol | 308.15 | - | 0.1672 | [323] |
| Isopropanol | 313.15 | - | 0.1909 | [323] |
| Isopropanol | 318.15 | - | 0.2127 | [323] |
| Isopropanol | 323.15 | - | 0.2407 | [323] |
| Water | 278.15 | - | 0.0058 | [323] |
| Water | 283.15 | - | 0.007 | [323] |
| Water | 288.15 | - | 0.0083 | [323] |
| Water | 293.15 | - | 0.0098 | [323] |
| Water | 298.15 | - | 0.0114 | [323] |
| Water | 303.15 | - | 0.0131 | [323] |
| Water | 308.15 | - | 0.0148 | [323] |
| Water | 313.15 | - | 0.01681 | [323] |
| Water | 318.15 | - | 0.019 | [323] |
| Water | 323.15 | - | 0.0214 | [323] |
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 471.0040 |
| PMI2 | 1612.1600 |
| PMI3 | 1910.7610 |
| NPR1 | 0.2465 |
| NPR2 | 0.8437 |
| RadiusOfGyration | 3.0748 |
| InertialShapeFactor | 0.0018 |
| Eccentricity | 0.9691 |
| Asphericity | 0.4344 |
| SpherocityIndex | 0.3061 |
| PBF | 0.5971 |