9-(3,4-difluorophenyl)-6,6-dimethyl-8-oxo-N-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
9-(3,4-difluorophenyl)-6,6-dimethyl-8-oxo-N-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
9-(3,4-difluorophenyl)-6,6-dimethyl-8-oxo-N-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | C202-4116 |
| Compound Name: | 9-(3,4-difluorophenyl)-6,6-dimethyl-8-oxo-N-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 448.47 |
| Molecular Formula: | C25 H22 F2 N4 O2 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(c(c3)F)F)n3c(c(cn3)C(Nc3ccccc3)=O)N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6378 |
| logD: | 4.3897 |
| logSw: | -4.3747 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.822 |
| InChI Key: | VBPPTAHUTKQBRZ-QFIPXVFZSA-N |