4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-(propan-2-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-(propan-2-yl)-2H-1-benzopyran-2-one
4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-(propan-2-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3838 |
| Compound Name: | 4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-(propan-2-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 396.92 |
| Molecular Formula: | C23 H25 Cl N2 O2 |
| Smiles: | CC(C)c1ccc2c(c1)C(CN1CCN(CC1)c1cccc(c1)[Cl])=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 4.9096 |
| logD: | 4.8637 |
| logSw: | -5.0139 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.6386 |
| InChI Key: | RBMDMUOFGINFAR-UHFFFAOYSA-N |