3-[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
3-[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8013-3800 |
| Compound Name: | 3-[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 403.26 |
| Molecular Formula: | C20 H16 Cl2 N2 O3 |
| Smiles: | C1CN(CCN1C(C1=Cc2ccccc2OC1=O)=O)c1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0063 |
| logD: | 4.0063 |
| logSw: | -4.4443 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.069 |
| InChI Key: | CKVXERYIPUNIMQ-UHFFFAOYSA-N |