N-{1-methyl-2-[(morpholin-4-yl)methyl]-1H-benzimidazol-5-yl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{1-methyl-2-[(morpholin-4-yl)methyl]-1H-benzimidazol-5-yl}-3-nitrobenzamide
N-{1-methyl-2-[(morpholin-4-yl)methyl]-1H-benzimidazol-5-yl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | D305-1551 |
| Compound Name: | N-{1-methyl-2-[(morpholin-4-yl)methyl]-1H-benzimidazol-5-yl}-3-nitrobenzamide |
| Molecular Weight: | 395.42 |
| Molecular Formula: | C20 H21 N5 O4 |
| Smiles: | Cn1c2ccc(cc2nc1CN1CCOCC1)NC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.143 |
| logD: | 2.1403 |
| logSw: | -2.9996 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.339 |
| InChI Key: | AQYJDFAGGXJSLU-UHFFFAOYSA-N |