N-(4-chlorophenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
N-(4-chlorophenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F453-0004 |
| Compound Name: | N-(4-chlorophenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 446.94 |
| Molecular Formula: | C25 H23 Cl N4 O2 |
| Smiles: | CC1(C)CC2=C(C(c3ccccc3)n3c(c(cn3)C(Nc3ccc(cc3)[Cl])=O)N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9749 |
| logD: | 4.7269 |
| logSw: | -5.0458 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.822 |
| InChI Key: | PBBYXVNTLFBFJX-QFIPXVFZSA-N |