6-chloro-4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
6-chloro-4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3831 |
| Compound Name: | 6-chloro-4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 322.79 |
| Molecular Formula: | C16 H19 Cl N2 O3 |
| Smiles: | C1CN(CCN1CCO)CC1=CC(=O)Oc2ccc(cc12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.2468 |
| logD: | 0.7513 |
| logSw: | -2.6357 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.824 |
| InChI Key: | WYWVBJASBQNLPI-UHFFFAOYSA-N |