N-[(4-methylphenyl)methyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
N-[(4-methylphenyl)methyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | K783-6606 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 322.4 |
| Molecular Formula: | C14 H14 N2 O3 S2 |
| Smiles: | Cc1ccc(CNC(CSc2ccsc2[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9427 |
| logD: | 2.9427 |
| logSw: | -3.3147 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.889 |
| InChI Key: | WYEJYOUVKAGVQR-UHFFFAOYSA-N |