N-(4-chlorophenyl)-9-(4-hydroxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-9-(4-hydroxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
N-(4-chlorophenyl)-9-(4-hydroxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F453-0063 |
| Compound Name: | N-(4-chlorophenyl)-9-(4-hydroxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 462.94 |
| Molecular Formula: | C25 H23 Cl N4 O3 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)O)n3c(c(cn3)C(Nc3ccc(cc3)[Cl])=O)N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3509 |
| logD: | 4.1028 |
| logSw: | -4.6224 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.439 |
| InChI Key: | KTRMFTPRGWFTGU-QFIPXVFZSA-N |