9-(4-hydroxyphenyl)-N-(3-methoxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
9-(4-hydroxyphenyl)-N-(3-methoxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
9-(4-hydroxyphenyl)-N-(3-methoxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | F453-0341 |
Compound Name: | 9-(4-hydroxyphenyl)-N-(3-methoxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide |
Molecular Weight: | 458.52 |
Molecular Formula: | C26 H26 N4 O4 |
Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)O)n3c(c(cn3)C(Nc3cccc(c3)OC)=O)N2)C(C1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8226 |
logD: | 3.5746 |
logSw: | -4.1706 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 85.983 |
InChI Key: | BQDMYFJCXNNWCC-QHCPKHFHSA-N |