3-[4-(4-chlorophenyl)piperazine-1-carbonyl]-5-methyl-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one
Chemical Structure Depiction of
3-[4-(4-chlorophenyl)piperazine-1-carbonyl]-5-methyl-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one
3-[4-(4-chlorophenyl)piperazine-1-carbonyl]-5-methyl-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one
Compound characteristics
| Compound ID: | S420-0378 |
| Compound Name: | 3-[4-(4-chlorophenyl)piperazine-1-carbonyl]-5-methyl-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one |
| Molecular Weight: | 438.96 |
| Molecular Formula: | C24 H27 Cl N4 O2 |
| Smiles: | CN1C2CCCCN2C(c2ccc(cc12)C(N1CCN(CC1)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1032 |
| logD: | 3.1032 |
| logSw: | -3.5928 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.197 |
| InChI Key: | QKJQGACPPHNZRH-QFIPXVFZSA-N |