RefChem:377177
1-[7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]pyridin-1-ium-3-carboxamide chloride
Also Known As: Pyridinium, 3-carbamoyl-1-(7-chloro-5-(2-chlorophenyl)-2,3-dihydro-2-oxo-1H-1,4-benzodiazepin-3-yl)-, chloride|3-carbamoyl-1-[7-chloro-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1h-1,4-benzodiazepin-3-yl]pyridinium chloride|1-[7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]pyridin-1-ium-3-carboxamide chloride|1-[7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]pyridin-1-ium-3-carboxamide,chloride|3-CARBAMOYL-1-(7-CHLORO-5-(2-CHLOROPHENYL)-2,3-DIHYDRO-2-OXO-1H-1,4-BENZODIAZEPIN-3-YL)PYRIDINIUM CHLORIDE|Pyridinium, 3-(aminocarbonyl)-1-[7-chloro-5-(2-chlorophenyl)-2,3-dihydro-2-oxo-1H-1,4-benzodiazepin-3-yl]-, chloride
| Molecular Formula | C21H15Cl3N4O2 |
|---|---|
| Molecular Weight | 460.02606 g/mol |
| LogP | 0.37 |
| Topological Polar Surface Area | 88.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 460.02606 |
| Heavy Atoms | 30 |
| Complexity | 1180.4 |
Chemical Identifiers
| CAS Number | 52995-06-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)[N+]4=CC=CC(=C4)C(=O)N)Cl.[Cl-] |
Product Overview
RefChem:377177 (CAS 52995-06-9), with molecular formula C21H15Cl3N4O2 and molecular weight 460.02606 g/mol. IUPAC: 1-[7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]pyridin-1-ium-3-carboxamide chloride.
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