2-methoxy-N-(6-{4-[(2-nitrophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Chemical Structure Depiction of
2-methoxy-N-(6-{4-[(2-nitrophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
2-methoxy-N-(6-{4-[(2-nitrophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Compound characteristics
| Compound ID: | V024-5048 |
| Compound Name: | 2-methoxy-N-(6-{4-[(2-nitrophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C25 H27 N5 O4 |
| Salt: | not_available |
| Smiles: | COc1ccccc1C(Nc1ccc(nc1)N1CCCN(CC1)Cc1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3092 |
| logD: | 4.2457 |
| logSw: | -4.1788 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.965 |
| InChI Key: | OUWHKNMCPOTIHF-UHFFFAOYSA-N |