4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-hydroxy-7-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-hydroxy-7-phenyl-2H-1-benzopyran-2-one
4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-hydroxy-7-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3946 |
| Compound Name: | 4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-hydroxy-7-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 446.93 |
| Molecular Formula: | C26 H23 Cl N2 O3 |
| Smiles: | C1CN(CCN1CC1=CC(=O)Oc2cc(c3ccccc3)c(cc12)O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4173 |
| logD: | 5.411 |
| logSw: | -5.5735 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.915 |
| InChI Key: | YWBRTMOQSYWZLU-UHFFFAOYSA-N |