N-[(4-methoxyphenyl)methyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
N-[(4-methoxyphenyl)methyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C700-0951 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 338.4 |
| Molecular Formula: | C14 H14 N2 O4 S2 |
| Smiles: | COc1ccc(CNC(CSc2ccsc2[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5016 |
| logD: | 2.5016 |
| logSw: | -2.6126 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.433 |
| InChI Key: | PCZWEPNITHKPMA-UHFFFAOYSA-N |