4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-7,8-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-7,8-dimethyl-2H-1-benzopyran-2-one
4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-7,8-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3999 |
| Compound Name: | 4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-7,8-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 382.89 |
| Molecular Formula: | C22 H23 Cl N2 O2 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)c3cccc(c3)[Cl])=CC(=O)Oc2c1C |
| Stereo: | ACHIRAL |
| logP: | 4.6118 |
| logD: | 4.5659 |
| logSw: | -4.6733 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.3229 |
| InChI Key: | RPXMDALGTZQTKE-UHFFFAOYSA-N |