6-[4-(trifluoromethyl)benzoyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
6-[4-(trifluoromethyl)benzoyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
6-[4-(trifluoromethyl)benzoyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S021-0073 |
| Compound Name: | 6-[4-(trifluoromethyl)benzoyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 362.31 |
| Molecular Formula: | C17 H13 F3 N4 O2 |
| Smiles: | [H]C1=CC2=NC3CN(CCC=3C(N2N1)=O)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8588 |
| logD: | 0.8586 |
| logSw: | -2.0017 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.016 |
| InChI Key: | CATJFXGIBJCTJX-UHFFFAOYSA-N |