6-(1H-benzimidazole-5-carbonyl)-2-(2-chlorophenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
6-(1H-benzimidazole-5-carbonyl)-2-(2-chlorophenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
6-(1H-benzimidazole-5-carbonyl)-2-(2-chlorophenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S021-1363 |
| Compound Name: | 6-(1H-benzimidazole-5-carbonyl)-2-(2-chlorophenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 444.88 |
| Molecular Formula: | C23 H17 Cl N6 O2 |
| Smiles: | C1CN(CC2=C1C(N1C(C=C(c3ccccc3[Cl])N1)=N2)=O)C(c1ccc2c(c1)nc[nH]2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8708 |
| logD: | 1.862 |
| logSw: | -3.2768 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.324 |
| InChI Key: | ONYJDLUSEMLJIC-UHFFFAOYSA-N |