N-(4-chlorophenyl)-9-(3,4-dimethoxyphenyl)-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-9-(3,4-dimethoxyphenyl)-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
N-(4-chlorophenyl)-9-(3,4-dimethoxyphenyl)-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F453-0237 |
| Compound Name: | N-(4-chlorophenyl)-9-(3,4-dimethoxyphenyl)-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 478.93 |
| Molecular Formula: | C25 H23 Cl N4 O4 |
| Smiles: | COc1ccc(cc1OC)C1C2=C(CCCC2=O)Nc2c(cnn12)C(Nc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0277 |
| logD: | 3.9095 |
| logSw: | -4.7214 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.083 |
| InChI Key: | LMVNNLMWSQZXAD-QHCPKHFHSA-N |