4-(ethylsulfanyl)-3-nitro-N-{4-[(pyridin-4-yl)methyl]phenyl}benzamide
Chemical Structure Depiction of
4-(ethylsulfanyl)-3-nitro-N-{4-[(pyridin-4-yl)methyl]phenyl}benzamide
4-(ethylsulfanyl)-3-nitro-N-{4-[(pyridin-4-yl)methyl]phenyl}benzamide
Compound characteristics
| Compound ID: | 8011-6290 |
| Compound Name: | 4-(ethylsulfanyl)-3-nitro-N-{4-[(pyridin-4-yl)methyl]phenyl}benzamide |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C21 H19 N3 O3 S |
| Smiles: | CCSc1ccc(cc1[N+]([O-])=O)C(Nc1ccc(Cc2ccncc2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3786 |
| logD: | 4.378 |
| logSw: | -4.2855 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.567 |
| InChI Key: | VHAXREBBRPJMDX-UHFFFAOYSA-N |