N-[4-chloro-2-(3,4,5-trimethoxybenzoyl)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[4-chloro-2-(3,4,5-trimethoxybenzoyl)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
N-[4-chloro-2-(3,4,5-trimethoxybenzoyl)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | K061-0036 |
| Compound Name: | N-[4-chloro-2-(3,4,5-trimethoxybenzoyl)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 617 |
| Molecular Formula: | C28 H20 Cl F3 N4 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(c1cc(ccc1NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1cccs1)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.2184 |
| logD: | 6.2012 |
| logSw: | -6.1883 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.254 |
| InChI Key: | AYIWLFJFCHFZGX-UHFFFAOYSA-N |