4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3917 |
| Compound Name: | 4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 302.37 |
| Molecular Formula: | C17 H22 N2 O3 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)CCO)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 1.1777 |
| logD: | 0.6822 |
| logSw: | -2.3448 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.824 |
| InChI Key: | BMXZCWXVPNCTCN-UHFFFAOYSA-N |