N-(3,4-dimethylphenyl)-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-(3,4-dimethylphenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
N-(3,4-dimethylphenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | F453-0319 |
Compound Name: | N-(3,4-dimethylphenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide |
Molecular Weight: | 440.54 |
Molecular Formula: | C27 H28 N4 O2 |
Smiles: | Cc1ccc(cc1C)NC(c1cnn2C(C3=C(CC(C)(C)CC3=O)Nc12)c1ccccc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.3676 |
logD: | 5.1196 |
logSw: | -5.2631 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 60.822 |
InChI Key: | MRFWWEHVTHVRCV-DEOSSOPVSA-N |