Clonazepam
CAS Number: 1622-61-3
Molecular Mass: 315.71 g/mol
Formula: C15H10ClN3O3
Smiles: O=C1CN=C(c2ccccc2Cl)c2cc([N+](=O)[O-])ccc2N1
Synonymes:
Clonazepam, clonazepam, Klonopin, Rivotril, 1622-61-3, Chlonazepam, Iktorivil, Cloazepam, Clonazepamum, Ravotril, Rivatril, 5-(2-chlorophenyl)-7-nitro-1,3-dihydro-1,4-benzodiazepin-2-one, Ro 4-8180, Klonopin Rapidly Disintegrating, Clonazepam civ, 5-(2-Chlorophenyl)-1,3-dihydro-7-nitro-2H-1,4-benzodiazepin-2-one, 2H-1,4-Benzodiazepin-2-one, 5-(2-chlorophenyl)-1,3-dihydro-7-nitro-, Ro-5-4023, 1,3-Dihydro-7-nitro-5-(2-chlorophenyl)-2H-1,4.benzodiazepin-2-one, Ro 54023, 5-(o-Chlorophenyl)-1,3-dihydro-7-nitro-2H-1,4-benzodiazepin-2-one, 5PE9FDE8GB, 7-Nitro-5-(2-chlorophenyl)-3H-1,4-benzodiazepin-2(1H)-one, Ro-54023, NSC-179913, DTXSID1022845, 2H-1,4-Benzodiazepin-2-one, 5-(o-chlorophenyl)-1,3-dihydro-7-nitro-, 5-(2-Chlorophenyl)-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one, 5-(o-Chlorophenyl)-7-nitro-1H-1,4-benzodiazepin-2(3H)-one, 5-(o-chlorophenyl)-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one, RO5-4023, CHEBI:3756, 5-(2-Chloro-phenyl)-7-nitro-1,3-dihydro-benzo[e][1,4]diazepin-2-one, 5-(2-chlorophenyl)-7-nitro-2,3-dihydro-1H-1,4-benzodiazepin-2-one, 5-(2-chlorophenyl)-7-nitro-1H-benzo(e)(1,4)diazepin-2(3H)-one, 5-(2-chlorophenyl)-7-nitro-1H-benzo[e][1,4]diazepin-2(3H)-one, 5-(2-Chloro-phenyl)-7-nitro-1,3-dihydro-benzo(e)(1,4)diazepin-2-one, RefChem:5697, DTXCID002845, N03AE01, 216-596-2, Antelepsin, Clonopin, Landsen, Antilepsin, Lonazep, Kenoket, Paxam, Ro 5-4023, NSC 179913, CHEMBL452, Lktorivil, NIOSH/DF2374250, Solfidin, Alti-Clonazepam, NSC179913, Melzap, DF23742500, 1,3-Dihydro-5-(o-chlorophenyl)-7-nitro-3H-1,4-benzodiazepin-2-one, 2-H-1,4-Benzodiazepin-2-one, 5-(o-chlorophenyl)-1,3-dihydro-7-nitro-, 106955-87-7, Clonazepamum [INN-Latin], Apetryl, 3H-1,4-Benzodiazepin-2-one, 1,3-dihydro-5-(o-chlorophenyl)-7-nitro-, Clonazepam (1.0 mg/mL in Methanol), Clonazepam (1.0mg/ml in Acetonitrile), Klonopin (TN), Ro 5-4023/B-7, HSDB 3265, EINECS 216-596-2, UNII-5PE9FDE8GB, BRN 0759557, DEA No. 2737, Clonazepam, powder, Ro 4023, RO4023, Clonazepam [USAN:USP:INN:BAN:JAN], CLONAZEPAM [MI], 5-(2-Chlorophenyl)-7-nitro-3H-1,4-benzodiazepin-2(1H)-one, CLONAZEPAM [INN], CLONAZEPAM [JAN], CLONAZEPAM [HSDB], CLONAZEPAM [USAN], 1,4.benzodiazepin-2-one, CLONAZEPAM [VANDF], Clonazepam CRS - * psy, CLONAZEPAM [MART.], CLONAZEPAM [WHO-DD], BIDD:PXR0144, Oprea1_168772, SCHEMBL38899, 5-24-04-00351 (Beilstein Handbook Reference), MLS003899214, DivK1c_000973, Clonazepam (JP18/USP/INN), GTPL6963, Clonazepam, 1mg/ml in Methanol, CLONAZEPAM [ORANGE BOOK], CLONAZEPAM CIV [USP-RS], SCHEMBL29361251, SCHEMBL29369721, SCHEMBL29743048, HMS503C07, KBio1_000973, CLONAZEPAM [EP MONOGRAPH], NINDS_000973, CLONAZEPAM [USP MONOGRAPH], HMS2093H22, Clonazepam 0.1 mg/ml in Methanol, Clonazepam 1.0 mg/ml in Methanol, VGA08215, BDBM50019213, AKOS015902192, Clonazepam (1 mg/ml in Acetonitrile), CCG-213669, DB01068, IDI1_000973, WLN: T67 GMV JN IHJ CNW KR BG, AC-15733, SMR000058982, SBI-0206863.P001, NS00010427, 5-(2-Chlorophenyl)-1,4-benzodiazepin-2-one, 5-(o-Chlorophenyl)-1,4-benzodiazepin-2-one, D00280, AB01563349_01, Q407988, SR-01000937610, 2-H-1, 5-(o-chlorophenyl)-1,3-dihydro-7-nitro-, 2H-1, 5-(2-chlorophenyl)-1,3-dihydro-7-nitro-, 2H-1, 5-(o-chlorophenyl)-1,3-dihydro-7-nitro-, Q-200880, SR-01000937610-2, BRD-K38183498-001-02-0, Clonazepam, European Pharmacopoeia (EP) Reference Standard, 5-(2-Chlorophenyl)-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one #, 7-nitro-1,3-dihydro-5-(o-chlorophenyl)-2H-1,4-benzodiazepin-2-one
Bioactivity: -
Solubility in Different Solvents
| Solvent | Temperature [K] | Crystal form | Solubility [mg/mL] | Reference |
|---|---|---|---|---|
| Ethanol | 298.2 | - | 1.872 | [403] |
| Ethanol | 303.2 | - | 2.19 | [403] |
| Ethanol | 308.2 | - | 2.839 | [403] |
| Ethanol | 313.2 | - | 3.07 | [403] |
| Ethanol | 318.2 | - | 3.433 | [403] |
| N-Methyl-2-pyrrolidone | 298.2 | - | 43.88 | [403] |
| N-Methyl-2-pyrrolidone | 303.2 | - | 46.81 | [403] |
| N-Methyl-2-pyrrolidone | 308.2 | - | 61.92 | [403] |
| N-Methyl-2-pyrrolidone | 313.2 | - | 68.24 | [403] |
| N-Methyl-2-pyrrolidone | 318.2 | - | 73.0 | [403] |
| Propylene Glycol | 298.2 | - | 2.747 | [403] |
| Propylene Glycol | 303.2 | - | 4.452 | [403] |
| Propylene Glycol | 308.2 | - | 4.613 | [403] |
| Propylene Glycol | 313.2 | - | 4.938 | [403] |
| Propylene Glycol | 318.2 | - | 5.847 | [403] |
| Water | 298.2 | - | 0.00332 | [403] |
| Water | 303.2 | - | 0.00418 | [403] |
| Water | 308.2 | - | 0.00452 | [403] |
| Water | 313.2 | - | 0.00503 | [403] |
| Water | 318.2 | - | 0.00554 | [403] |
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 1810.0351 |
| PMI2 | 1928.8299 |
| PMI3 | 3001.2963 |
| NPR1 | 0.6031 |
| NPR2 | 0.6427 |
| RadiusOfGyration | 3.2672 |
| InertialShapeFactor | 0.0004 |
| Eccentricity | 0.7977 |
| Asphericity | 0.1137 |
| SpherocityIndex | 0.3015 |
| PBF | 0.9370 |