4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-5,7-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-5,7-dimethyl-2H-1-benzopyran-2-one
4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-5,7-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-0761 |
| Compound Name: | 4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-5,7-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 396.92 |
| Molecular Formula: | C23 H25 Cl N2 O2 |
| Smiles: | Cc1cc(C)c2C(CN3CCN(CC3)c3cc(ccc3C)[Cl])=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.2081 |
| logD: | 5.1187 |
| logSw: | -5.8656 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.3377 |
| InChI Key: | HEWAZVWULPENQI-UHFFFAOYSA-N |