6-(2-chlorobenzoyl)-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
6-(2-chlorobenzoyl)-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
6-(2-chlorobenzoyl)-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S021-1040 |
| Compound Name: | 6-(2-chlorobenzoyl)-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 404.85 |
| Molecular Formula: | C22 H17 Cl N4 O2 |
| Smiles: | C1CN(CC2=C1C(N1C(C=C(c3ccccc3)N1)=N2)=O)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5909 |
| logD: | 2.5908 |
| logSw: | -3.7525 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.794 |
| InChI Key: | JJUVWHIIJDLYOE-UHFFFAOYSA-N |