6,8-dichloro-3-[4-(3-chloro-4-methylphenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6,8-dichloro-3-[4-(3-chloro-4-methylphenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
6,8-dichloro-3-[4-(3-chloro-4-methylphenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8014-2296 |
| Compound Name: | 6,8-dichloro-3-[4-(3-chloro-4-methylphenyl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 451.74 |
| Molecular Formula: | C21 H17 Cl3 N2 O3 |
| Smiles: | Cc1ccc(cc1[Cl])N1CCN(CC1)C(C1=Cc2cc(cc(c2OC1=O)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2888 |
| logD: | 5.2888 |
| logSw: | -5.9538 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.753 |
| InChI Key: | GGGDCUSQSRAOPC-UHFFFAOYSA-N |