N-(4-chloro-2-nitrophenyl)-3-oxo-1,2,3,5-tetrahydropyrido[1,2-a]benzimidazole-4-carboxamide
Chemical Structure Depiction of
N-(4-chloro-2-nitrophenyl)-3-oxo-1,2,3,5-tetrahydropyrido[1,2-a]benzimidazole-4-carboxamide
N-(4-chloro-2-nitrophenyl)-3-oxo-1,2,3,5-tetrahydropyrido[1,2-a]benzimidazole-4-carboxamide
Compound characteristics
| Compound ID: | D090-0066 |
| Compound Name: | N-(4-chloro-2-nitrophenyl)-3-oxo-1,2,3,5-tetrahydropyrido[1,2-a]benzimidazole-4-carboxamide |
| Molecular Weight: | 384.78 |
| Molecular Formula: | C18 H13 Cl N4 O4 |
| Smiles: | C1CN2C(=C(C1=O)C(Nc1ccc(cc1[N+]([O-])=O)[Cl])=O)Nc1ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.4646 |
| logD: | 0.9554 |
| logSw: | -3.9629 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.494 |
| InChI Key: | OMNRVTCSTIAGOK-UHFFFAOYSA-N |