4-[(3-chlorophenyl)sulfanyl]-3-nitro-N-[(thiophen-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-[(3-chlorophenyl)sulfanyl]-3-nitro-N-[(thiophen-2-yl)methyl]benzamide
4-[(3-chlorophenyl)sulfanyl]-3-nitro-N-[(thiophen-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | K781-2305 |
| Compound Name: | 4-[(3-chlorophenyl)sulfanyl]-3-nitro-N-[(thiophen-2-yl)methyl]benzamide |
| Molecular Weight: | 404.89 |
| Molecular Formula: | C18 H13 Cl N2 O3 S2 |
| Smiles: | C(c1cccs1)NC(c1ccc(c(c1)[N+]([O-])=O)Sc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4386 |
| logD: | 5.4386 |
| logSw: | -5.9823 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.479 |
| InChI Key: | CTKVVMNPJFOVMX-UHFFFAOYSA-N |