methyl 2-(2-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(2-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
methyl 2-(2-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8009-7653 |
| Compound Name: | methyl 2-(2-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 431.45 |
| Molecular Formula: | C17 H16 F3 N3 O3 S2 |
| Smiles: | Cc1cc(C(F)(F)F)nc(n1)SCC(Nc1c(C(=O)OC)c2CCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.701 |
| logD: | 1.6558 |
| logSw: | -4.1465 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.471 |
| InChI Key: | UECZUAJHZBYSHK-UHFFFAOYSA-N |