2-(2-chlorophenyl)-6-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
2-(2-chlorophenyl)-6-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
2-(2-chlorophenyl)-6-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one
Compound characteristics
Compound ID: | S021-1398 |
Compound Name: | 2-(2-chlorophenyl)-6-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidin-9(1H)-one |
Molecular Weight: | 448.91 |
Molecular Formula: | C23 H21 Cl N6 O2 |
Smiles: | C1CCc2c(C1)c(C(N1CCC3=C(C1)N=C1C=C(c4ccccc4[Cl])NN1C3=O)=O)n[nH]2 |
Stereo: | ACHIRAL |
logP: | 2.4426 |
logD: | 2.4417 |
logSw: | -3.5398 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.747 |
InChI Key: | GMVBINDMQKRKDL-UHFFFAOYSA-N |