N-(3-chloro-4-methoxyphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C797-0020 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 358.82 |
| Molecular Formula: | C13 H11 Cl N2 O4 S2 |
| Smiles: | COc1ccc(cc1[Cl])NC(CSc1ccsc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3486 |
| logD: | 3.3482 |
| logSw: | -3.7011 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.197 |
| InChI Key: | DMXLVUXTZXAJKX-UHFFFAOYSA-N |