4-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
4-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D154-0144 |
| Compound Name: | 4-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 368.86 |
| Molecular Formula: | C21 H21 Cl N2 O2 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)c3ccc(cc3)[Cl])=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.1695 |
| logD: | 4.1603 |
| logSw: | -4.5355 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.6386 |
| InChI Key: | PXTKRPYDOXRURI-UHFFFAOYSA-N |