N-(4-ethoxyphenyl)-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-ethoxyphenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
N-(4-ethoxyphenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | F453-0005 |
Compound Name: | N-(4-ethoxyphenyl)-6,6-dimethyl-8-oxo-9-phenyl-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide |
Molecular Weight: | 456.54 |
Molecular Formula: | C27 H28 N4 O3 |
Smiles: | CCOc1ccc(cc1)NC(c1cnn2C(C3=C(CC(C)(C)CC3=O)Nc12)c1ccccc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.7492 |
logD: | 4.5011 |
logSw: | -4.3822 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 67.946 |
InChI Key: | GBQPXJSYEJRMOT-DEOSSOPVSA-N |