ethyl 5-acetyl-4-methyl-2-{2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-4-methyl-2-{2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetamido}thiophene-3-carboxylate
ethyl 5-acetyl-4-methyl-2-{2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6466-0114 |
| Compound Name: | ethyl 5-acetyl-4-methyl-2-{2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 443.44 |
| Molecular Formula: | C19 H20 F3 N3 O4 S |
| Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(Cn1c2CCCc2c(C(F)(F)F)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8413 |
| logD: | -0.0553 |
| logSw: | -3.0683 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.509 |
| InChI Key: | ZYHMMZKXEPBCHZ-UHFFFAOYSA-N |