N-(4-methylphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-methylphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
N-(4-methylphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C797-0033 |
| Compound Name: | N-(4-methylphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 308.38 |
| Molecular Formula: | C13 H12 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)NC(CSc1ccsc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2613 |
| logD: | 3.2613 |
| logSw: | -3.4857 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.567 |
| InChI Key: | VFUBPBFDMSRQDP-UHFFFAOYSA-N |