2-[(1H-benzimidazol-2-yl)sulfanyl]-5-nitro-N-[(oxolan-2-yl)methyl]benzamide
Chemical Structure Depiction of
2-[(1H-benzimidazol-2-yl)sulfanyl]-5-nitro-N-[(oxolan-2-yl)methyl]benzamide
2-[(1H-benzimidazol-2-yl)sulfanyl]-5-nitro-N-[(oxolan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | 8017-1053 |
| Compound Name: | 2-[(1H-benzimidazol-2-yl)sulfanyl]-5-nitro-N-[(oxolan-2-yl)methyl]benzamide |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C19 H18 N4 O4 S |
| Smiles: | C1CC(CNC(c2cc(ccc2Sc2nc3ccccc3[nH]2)[N+]([O-])=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9579 |
| logD: | 2.956 |
| logSw: | -3.6215 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.429 |
| InChI Key: | IPHAINIWHAVWKR-CYBMUJFWSA-N |