6-[(2-chloro-6-fluorophenyl)acetyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
6-[(2-chloro-6-fluorophenyl)acetyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
6-[(2-chloro-6-fluorophenyl)acetyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S021-0954 |
| Compound Name: | 6-[(2-chloro-6-fluorophenyl)acetyl]-2-phenyl-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 436.87 |
| Molecular Formula: | C23 H18 Cl F N4 O2 |
| Smiles: | C1CN(CC2=C1C(N1C(C=C(c3ccccc3)N1)=N2)=O)C(Cc1c(cccc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2063 |
| logD: | 3.2062 |
| logSw: | -3.6221 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.266 |
| InChI Key: | BQVXXTUMNFVDIE-UHFFFAOYSA-N |