ethyl 2-(2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-(2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8012-9651 |
| Compound Name: | ethyl 2-(2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 435.44 |
| Molecular Formula: | C15 H16 F3 N5 O3 S2 |
| Smiles: | CCOC(c1c2CCCc2sc1NC(CSc1nnc(C(F)(F)F)n1N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2158 |
| logD: | 0.1441 |
| logSw: | -2.5486 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.395 |
| InChI Key: | LVXLHIZZMOLRGT-UHFFFAOYSA-N |