Lamotrigine
CAS Number: 84057-84-1
Molecular Mass: 256.09 g/mol
Formula: C9H7Cl2N5
Smiles: Nc1nnc(-c2cccc(Cl)c2Cl)c(N)n1
Synonymes:
Lamotrigine, lamotrigine, 84057-84-1, 6-(2,3-Dichlorophenyl)-1,2,4-triazine-3,5-diamine, Lamictal, Lamictal Cd, Lamotrigina, Lamictal XR, Lamotriginum, BW 430C, 3,5-Diamino-6-(2,3-dichlorophenyl)-1,2,4-triazine, BW-430C, Lamictal ODT, 1,2,4-Triazine-3,5-diamine, 6-(2,3-dichlorophenyl)-, 3,5-Diamino-6-(2,3-dichlorophenyl)-as-triazine, BW430C, DTXSID2023195, NSC-759171, SUBVENITE, GW 273293, U3H27498KS, CHEBI:6367, DTXCID203195, Lamotirigine, Lamotrigine ER, LAMOTRIGINE Kit, RefChem:5936, lamotrigine extended-release, Lamotrigine Extended Release, lamotrigine chewable dispersible, N03AX09, 281-901-8, 658-035-8, Lamotriginum [Latin], Lamotrigina [Spanish], Labileno, Lamitor, C9H7Cl2N5, MFCD00865333, LTG, BW430C, CHEMBL741, MLS000069685, s3024, NCGC00015605-06, Lamictin, SMR000058464, 6-(2,3-Dichloro-phenyl)-[1,2,4]triazine-3,5-diamine, (6M)-6-(2,3-dichlorophenyl)-1,2,4-triazine-3,5-diamine, Lamictal (TN), CAS-84057-84-1, SR-01000000187, EINECS 281-901-8, Epilepax, UNII-U3H27498KS, Lamictal, , Lamotrigine CRS, HSDB 7526, EUR-1048, IYJ, Lamotrigine [USAN:USP:INN:BAN], Opera_ID_12, Lamotrigine (Standard), Tocris-1611, LAMOTRIGINE [MI], LAMOTRIGINE [INN], LAMOTRIGINE [JAN], Lopac-L-3791, LAMOTRIGINE [HSDB], LAMOTRIGINE [USAN], L 3791, LAMOTRIGINE [MART.], Lopac0_000688, SCHEMBL35439, LAMOTRIGINE [USP-RS], LAMOTRIGINE [WHO-DD], MLS000759486, MLS001077325, MLS001423991, BIDD:GT0794, Lamotrigine (JAN/USP/INN), Lamotrigine, >=98%, powder, GTPL2622, orb1310392, orb3141187, Lamotrigine, 1mg/ml in Ethanol, Lamotrigine - Bio-X trade mark, SCHEMBL29360953, SCHEMBL29801510, HY-B0495R, LAMOTRIGINE [EP IMPURITY], LAMOTRIGINE [ORANGE BOOK], GLXC-07355, HMS2051C10, HMS2089M08, HMS2093P21, HMS2230L04, HMS3262I17, HMS3268G17, HMS3371O16, HMS3393C10, HMS3657A17, HMS3715H21, HMS3885M03, HMS5081I06, LAMOTRIGINE [EP MONOGRAPH], LAMOTRIGINE [USP IMPURITY], Pharmakon1600-01505610, LAMOTRIGINE [USP MONOGRAPH], HY-B0495, Lamotrigine 1.0 mg/ml in Methanol, MSK10267, Tox21_110179, Tox21_500688, BDBM50031299, EBC-03614, HB0368, NSC746307, NSC759171, STK628377, AKOS005561147, Lamotrigine for system suitability CRS, Tox21_110179_1, 6-(2,2,4-triazine-3,5-diyldiamine, CCG-100856, DB00555, ID58057, KS-1074, Lamotrigine for peak identification CRS, LP00688, NC00106, NSC 746307, NSC 759171, NSC-746307, SDCCGSBI-0050666.P003, SMP2_000303, NCGC00015605-01, NCGC00015605-02, NCGC00015605-03, NCGC00015605-04, NCGC00015605-05, NCGC00015605-07, NCGC00015605-08, NCGC00015605-09, NCGC00015605-10, NCGC00015605-23, NCGC00015605-24, NCGC00022936-02, NCGC00022936-04, NCGC00022936-05, NCGC00261373-01, AC-10298, AC-32483, BL166799, Lamotrigine 100 microg/mL in Acetonitrile, SBI-0050666.P002, DB-014839, EU-0100688, L0241, NS00000354, SW197486-3, D00354, EN300-120680, W13018, AB00384359-16, AB00384359_17, AB00384359_18, F093440, Q410346, 3,5-diamino-(2,3-dichlorophenyl)-1,2,4-triazine, SR-01000000187-2, SR-01000000187-4, SR-01000000187-7, BRD-K93460210-001-22-9, BRD-K93460210-001-23-7, BRD-K93460210-071-01-6, SR-01000000187-10, 3,5-diamino-6-(2,3,-dichlorophenyl)-1,2,4-triazine, F2173-0540, Z1532338577, Lamotrigine Working Standard (Secondary Reference Standard), Lamotrigine, British Pharmacopoeia (BP) Reference Standard, Lamotrigine, European Pharmacopoeia (EP) Reference Standard, 1,2,4-TRIAZINE-3,5-DIAMINE, 6-(2,3-DICHLOROPHENYL), 6-(2,3-Dichloro-phenyl)-[1,2,4]triazine-3,5-diamine(lamotrigine), GI 267119X, 6-(2,3-dichlorophenyl)-1,2,4-triazine-3,5-diamine, Lamotrigine, United States Pharmacopeia (USP) Reference Standard, Lamotrigine, Pharmaceutical Secondary Standard, Certified Reference Material, Lamotrigine for peak identification, European Pharmacopoeia (EP) Reference Standard, Lamotrigine for system suitability, European Pharmacopoeia (EP) Reference Standard
Bioactivity: -
Solubility in Different Solvents
| Solvent | Temperature [K] | Crystal form | Solubility [mg/mL] | Reference |
|---|---|---|---|---|
| Acetonitrile | 283.1 | - | 2.824 | [191] |
| Acetonitrile | 293.1 | - | 3.334 | [191] |
| Acetonitrile | 303.1 | - | 6.879 | [191] |
| Acetonitrile | 313.1 | - | 9.859 | [191] |
| Acetonitrile | 323.1 | - | 14.27 | [191] |
| Ethyl acetate | 283.1 | - | 3.427 | [191] |
| Ethyl acetate | 293.1 | - | 4.214 | [191] |
| Ethyl acetate | 303.1 | - | 5.308 | [191] |
| Ethyl acetate | 313.1 | - | 7.085 | [191] |
| Ethyl acetate | 323.1 | - | 9.608 | [191] |
| Isopropanol | 293.2 | - | 10.0 | [437] |
| Isopropanol | 298.2 | - | 12.3 | [437] |
| Isopropanol | 303.2 | - | 15.33 | [437] |
| Isopropanol | 308.2 | - | 16.51 | [437] |
| Isopropanol | 313.2 | - | 20.09 | [437] |
| Methanol | 283.1 | - | 1.243 | [191] |
| Methanol | 293.1 | - | 3.383 | [191] |
| Methanol | 303.1 | - | 8.982 | [191] |
| Methanol | 313.1 | - | 17.52 | [191] |
| Methanol | 323.1 | - | 28.12 | [191] |
| Water | 283.1 | - | 0.0798 | [191] |
| Water | 293.1 | - | 0.11 | [191] |
| Water | 293.15 | - | 0.109 | [438] |
| Water | 293.2 | - | 0.1589 | [437] |
| Water | 298.15 | - | 0.14 | [438] |
| Water | 298.15 | - | 0.1885 | [439] |
| Water | 298.2 | - | 0.1954 | [437] |
| Water | 303.1 | - | 0.1639 | [191] |
| Water | 303.15 | - | 0.17 | [438] |
| Water | 303.15 | - | 0.4444 | [439] |
| Water | 303.2 | - | 0.356 | [437] |
| Water | 308.15 | - | 0.24 | [438] |
| Water | 308.15 | - | 0.5879 | [439] |
| Water | 308.2 | - | 0.6203 | [437] |
| Water | 313.1 | - | 0.287 | [191] |
| Water | 313.15 | - | 0.296 | [438] |
| Water | 313.15 | - | 1.031 | [439] |
| Water | 313.2 | - | 1.148 | [437] |
| Water | 323.1 | - | 0.4216 | [191] |
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 523.7105 |
| PMI2 | 2020.6928 |
| PMI3 | 2273.3229 |
| NPR1 | 0.2304 |
| NPR2 | 0.8889 |
| RadiusOfGyration | 3.0669 |
| InertialShapeFactor | 0.0017 |
| Eccentricity | 0.9731 |
| Asphericity | 0.4624 |
| SpherocityIndex | 0.1906 |
| PBF | 0.6778 |