3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-6,7,8,9-tetrahydro-11H-pyrido[2,1-b]quinazolin-11-one
Chemical Structure Depiction of
3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-6,7,8,9-tetrahydro-11H-pyrido[2,1-b]quinazolin-11-one
3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-6,7,8,9-tetrahydro-11H-pyrido[2,1-b]quinazolin-11-one
Compound characteristics
| Compound ID: | E475-0158 |
| Compound Name: | 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-6,7,8,9-tetrahydro-11H-pyrido[2,1-b]quinazolin-11-one |
| Molecular Weight: | 416.52 |
| Molecular Formula: | C25 H28 N4 O2 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1ccc2C(N3CCCCC3=Nc2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0762 |
| logD: | 3.0756 |
| logSw: | -3.2081 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.996 |
| InChI Key: | BVVLHNGOJJZWMW-UHFFFAOYSA-N |