ethyl 2-{[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-4,5-dimethylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-4,5-dimethylthiophene-3-carboxylate
ethyl 2-{[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-4,5-dimethylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | K061-0044 |
| Compound Name: | ethyl 2-{[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-4,5-dimethylthiophene-3-carboxylate |
| Molecular Weight: | 518.51 |
| Molecular Formula: | C24 H21 F3 N4 O4 S |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6526 |
| logD: | 2.9647 |
| logSw: | -5.5572 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.58 |
| InChI Key: | LQJDXJVSNIVSPH-UHFFFAOYSA-N |