ethyl 2-{[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-{[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-0440 |
| Compound Name: | ethyl 2-{[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 530.52 |
| Molecular Formula: | C25 H21 F3 N4 O4 S |
| Smiles: | CCOC(c1c2CCCc2sc1NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6999 |
| logD: | 3.0326 |
| logSw: | -5.4812 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.867 |
| InChI Key: | XCYKIPWXUVKTJN-UHFFFAOYSA-N |