Econazole nitrate
CAS Number: 24169-02-6
Molecular Mass: 444.7 g/mol
Formula: C18H16Cl3N3O4
Smiles: Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1.O=[N+]([O-])O
Synonymes:
Econazole nitrate, 24169-02-6, Ifenec, Spectazole, Pevaryl, Epi-pevaryl, (+-)-Econazole nitrate, Gyno-Pevaryl 150, Econazole mononitrate, Palavale, Ecoza, R 14827, H438WYN10E, DTXSID6025226, R 14,827, SQ13050, 1-(2,4-Dichloro-beta-((p-chlorobenzyl)oxy)phenethyl)imidazole nitrate, SQ-13050, DTXCID905226, R14827, R-14827, 1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole, nitric acid, Imidazole, 1-(2,4-dichloro-beta-((p-chlorobenzyl)oxy)phenethyl)-, mononitrate, NSC243115, 1H-Imidazole, 1-(2-((4-chlorophenyl)methoxy)-2-(2,4-dichlorophenyl)ethyl)-, mononitrate, Ecostatin-1, Gyno-pevaryl once, 1-(2-((4-chlorophenyl)methoxy)-2-(2,4-dichlorophenyl)ethyl)imidazole, nitric acid, Nitrate, Econazole, Ecostatin twin pack, RefChem:55090, Gyno-pevaryl 1 cp pack, CHEBI:4755, 1-(2-((4-chloro-phenyl)methoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole Mononitrate, Ecostatin, 68797-31-9, Gyno-pevaryl, Econazole (nitrate), Econazole nitrate salt, MFCD00058160, NSC 243115, Econazole nitrate (Spectazole), SQ 13050, 1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole nitrate, MLS000028626, NSC-243115, SMR000058732, EcoNail, 1-{2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole, nitric acid, C18H16Cl3N3O4, CCRIS 6031, 1-(2-((4-Chlorophenyl)methoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazolium nitrate, SR-01000003142, NCGC00018258-03, EINECS 246-053-5, UNII-H438WYN10E, Micogin, Spectazole (TN), Prestwick_191, GYNORYL, Ecoza (TN), Econazole nitrate CRS, Econazole nitrate [USAN:USP:BAN:JAN], 24169-02-6 (NITRATE), 1-[2-[(4-chlorobenzyl)oxy]-2-(2,4-dichlorophenyl)ethyl]-1H-imidazole nitrate, Opera_ID_1393, Miconazole EP Impurity B, CAS-24169-02-6, SCHEMBL36213, MLS001076561, MLS002222182, MLS002415728, Econazole nitrate (JAN/USP), SPECTRUM1501185, REGID_for_CID_68589, ECONAZOLE NITRATE [MI], Econazole Nitrate(discontinued), orb1310609, orb3025592, ECONAZOLE NITRATE [JAN], CHEMBL1201049, ECONAZOLE NITRATE [USAN], SCHEMBL29379555, HMS500F15, ECONAZOLE NITRATE [VANDF], DDXORDQKGIZAME-UHFFFAOYSA-N, ECONAZOLE NITRATE [MART.], HMS1568N10, HMS1921P03, HMS2092L03, HMS2095N10, HMS2235C19, HMS3656C14, HMS3712N10, HMS5081I19, Pharmakon1600-01501185, ECONAZOLE NITRATE [USP-RS], ECONAZOLE NITRATE [WHO-DD], HY-B0453, MSK10184, Tox21_110852, Tox21_200771, Tox21_303391, CCG-38966, Econazole for system suitability CRS, NSC757882, s2535, T0444L, AKOS015895218, Tox21_110852_1, AB02338, AC-1113, EBC-108078, ECONAZOLE NITRATE [EP IMPURITY], ECONAZOLE NITRATE [ORANGE BOOK], FE22641, NSC 757882, NSC-757882, 1H-Imidazole, 1-(2-((4-chlorophenyl)methoxy)-2-(2,4-dichlorophenyl)ethyl)-, nitrate, ECONAZOLE NITRATE [EP MONOGRAPH], ECONAZOLE NITRATE [USP MONOGRAPH], NCGC00018258-10, NCGC00089813-02, NCGC00094926-01, NCGC00094926-02, NCGC00094926-03, NCGC00094926-04, NCGC00257500-01, NCGC00258325-01, AS-13263, SY074389, E0957, SW196500-3, VU0239797-5, C08069, D00881, 1H-Imidazole,4-dichlorophenyl]ethyl)-, nitrate, F858778, 1H-Imidazole,4-dichlorophenyl)ethyl]-, mononitrate, SR-01000003142-2, SR-01000003142-3, Q27279621, 1-[2-(4-Chlorobenzyloxy)-2-(2,4-dichlorophenyl)ethyl]im idazole nitrate, 1-[2-(4-Chlorobenzyloxy)-2-(2,4-dichlorophenyl)ethyl]imidazole Nitrate, Imidazole,4-dichloro-.beta.-[(p-chlorobenzyl)oxy]phenethyl]-, mononitrate, (+/-)-1-(2,4-DICHLORO-.BETA.-((P-CHLOROBENZYL)OXY)PHENETHYL)-IMIDAZOLE MONONITRATE, 1H-IMIDAZOLE, 1-(2-((4-CHLOROPHENYL)METHOXY)-2-(2,4-DICHLOROPHENYL)ETHYL)-, MONONITRATE, (+/-)-, Nitric acid--1-{2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole (1/1)
Bioactivity: -
Solubility in Different Solvents
| Solvent | Temperature [K] | Crystal form | Solubility [mg/mL] | Reference |
|---|---|---|---|---|
| 1,4-Dioxane | 288.15 | - | 1.375 | [99] |
| 1,4-Dioxane | 293.15 | - | 1.657 | [99] |
| 1,4-Dioxane | 298.15 | - | 2.039 | [99] |
| 1,4-Dioxane | 303.15 | - | 2.488 | [99] |
| 1,4-Dioxane | 308.15 | - | 3.063 | [99] |
| 1,4-Dioxane | 313.15 | - | 3.725 | [99] |
| 1,4-Dioxane | 318.15 | - | 4.554 | [99] |
| Ethanol | 278.15 | - | 4.074 | [99] |
| Ethanol | 283.15 | - | 5.055 | [99] |
| Ethanol | 288.15 | - | 6.376 | [99] |
| Ethanol | 293.15 | - | 7.744 | [99] |
| Ethanol | 298.15 | - | 9.459 | [99] |
| Ethanol | 303.15 | - | 11.57 | [99] |
| Ethanol | 308.15 | - | 14.16 | [99] |
| Ethanol | 313.15 | - | 17.01 | [99] |
| Ethanol | 318.15 | - | 20.44 | [99] |
| Methanol | 278.15 | - | 16.8 | [99] |
| Methanol | 283.15 | - | 20.18 | [99] |
| Methanol | 288.15 | - | 24.5 | [99] |
| Methanol | 293.15 | - | 29.32 | [99] |
| Methanol | 298.15 | - | 35.9 | [99] |
| Methanol | 303.15 | - | 43.26 | [99] |
| Methanol | 308.15 | - | 51.88 | [99] |
| Methanol | 313.15 | - | 62.23 | [99] |
| Methanol | 318.15 | - | 73.66 | [99] |
| Water | 278.15 | - | 0.4132 | [99] |
| Water | 283.15 | - | 0.5057 | [99] |
| Water | 288.15 | - | 0.6089 | [99] |
| Water | 293.15 | - | 0.723 | [99] |
| Water | 298.15 | - | 0.8469 | [99] |
| Water | 303.15 | - | 0.9792 | [99] |
| Water | 308.15 | - | 1.119 | [99] |
| Water | 313.15 | - | 1.264 | [99] |
| Water | 318.15 | - | 1.412 | [99] |
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 2003.8415 |
| PMI2 | 5308.2799 |
| PMI3 | 5914.7545 |
| NPR1 | 0.3388 |
| NPR2 | 0.8975 |
| RadiusOfGyration | 3.8564 |
| InertialShapeFactor | 0.0004 |
| Eccentricity | 0.9409 |
| Asphericity | 0.3039 |
| SpherocityIndex | 0.3951 |
| PBF | 1.0455 |