4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-5,7,8-trimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-5,7,8-trimethyl-2H-1-benzopyran-2-one
4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-5,7,8-trimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-4012 |
| Compound Name: | 4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-5,7,8-trimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 396.92 |
| Molecular Formula: | C23 H25 Cl N2 O2 |
| Smiles: | Cc1cc(C)c2C(CN3CCN(CC3)c3cccc(c3)[Cl])=CC(=O)Oc2c1C |
| Stereo: | ACHIRAL |
| logP: | 4.965 |
| logD: | 4.8756 |
| logSw: | -5.149 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.3229 |
| InChI Key: | ZMDWXMXHJMCDDO-UHFFFAOYSA-N |