N-(3,4-dimethylphenyl)-9-(3-hydroxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-9-(3-hydroxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
N-(3,4-dimethylphenyl)-9-(3-hydroxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F453-0347 |
| Compound Name: | N-(3,4-dimethylphenyl)-9-(3-hydroxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C27 H28 N4 O3 |
| Smiles: | Cc1ccc(cc1C)NC(c1cnn2C(C3=C(CC(C)(C)CC3=O)Nc12)c1cccc(c1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9262 |
| logD: | 4.6782 |
| logSw: | -4.2213 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.439 |
| InChI Key: | CRYNPEBCYLSSLM-DEOSSOPVSA-N |