ethyl 2-{2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-{2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-0381 |
| Compound Name: | ethyl 2-{2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 401.41 |
| Molecular Formula: | C17 H18 F3 N3 O3 S |
| Smiles: | CCOC(c1c2CCCc2sc1NC(Cn1c(C)cc(C(F)(F)F)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2187 |
| logD: | 0.8516 |
| logSw: | -3.4467 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.151 |
| InChI Key: | BKIRCXTWPNDGMU-UHFFFAOYSA-N |