N-[4-chloro-3-(trifluoromethyl)phenyl]-9-oxo-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidine-6(1H)-carboxamide
Chemical Structure Depiction of
N-[4-chloro-3-(trifluoromethyl)phenyl]-9-oxo-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidine-6(1H)-carboxamide
N-[4-chloro-3-(trifluoromethyl)phenyl]-9-oxo-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidine-6(1H)-carboxamide
Compound characteristics
| Compound ID: | S021-0327 |
| Compound Name: | N-[4-chloro-3-(trifluoromethyl)phenyl]-9-oxo-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidine-6(1H)-carboxamide |
| Molecular Weight: | 411.77 |
| Molecular Formula: | C17 H13 Cl F3 N5 O2 |
| Smiles: | [H]C1=CC2=NC3CN(CCC=3C(N2N1)=O)C(Nc1ccc(c(c1)C(F)(F)F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9752 |
| logD: | 1.9725 |
| logSw: | -3.4522 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.837 |
| InChI Key: | ZKVZLXRXPNROHT-UHFFFAOYSA-N |