ethyl 4-{2-[(2-nitrothiophen-3-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[(2-nitrothiophen-3-yl)sulfanyl]acetamido}benzoate
ethyl 4-{2-[(2-nitrothiophen-3-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | C797-0021 |
| Compound Name: | ethyl 4-{2-[(2-nitrothiophen-3-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 366.41 |
| Molecular Formula: | C15 H14 N2 O5 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(CSc1ccsc1[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4394 |
| logD: | 3.4392 |
| logSw: | -3.674 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.32 |
| InChI Key: | UXGZPRHSCICBQN-UHFFFAOYSA-N |