2-acetyl-4-(4-chlorophenyl)-3,7-dimethyl-4,6-dihydropyrazolo[4',3':5,6]pyrano[2,3-d]pyrimidin-5(2H)-one
Chemical Structure Depiction of
2-acetyl-4-(4-chlorophenyl)-3,7-dimethyl-4,6-dihydropyrazolo[4',3':5,6]pyrano[2,3-d]pyrimidin-5(2H)-one
2-acetyl-4-(4-chlorophenyl)-3,7-dimethyl-4,6-dihydropyrazolo[4',3':5,6]pyrano[2,3-d]pyrimidin-5(2H)-one
Compound characteristics
Compound ID: | 8019-5485 |
Compound Name: | 2-acetyl-4-(4-chlorophenyl)-3,7-dimethyl-4,6-dihydropyrazolo[4',3':5,6]pyrano[2,3-d]pyrimidin-5(2H)-one |
Molecular Weight: | 370.79 |
Molecular Formula: | C18 H15 Cl N4 O3 |
Smiles: | CC1NC(C2C(c3ccc(cc3)[Cl])c3c(nn(C(C)=O)c3C)OC=2N=1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.716 |
logD: | 1.7159 |
logSw: | -3.0938 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.084 |
InChI Key: | YMCRHIBFCFVONZ-CQSZACIVSA-N |