4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-6,8-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-6,8-dimethyl-2H-1-benzopyran-2-one
4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-6,8-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3841 |
| Compound Name: | 4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-6,8-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 316.4 |
| Molecular Formula: | C18 H24 N2 O3 |
| Smiles: | Cc1cc(C)c2c(c1)C(CN1CCN(CC1)CCO)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 1.694 |
| logD: | 1.1986 |
| logSw: | -2.1134 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.508 |
| InChI Key: | CPNTXAVGHOOWSN-UHFFFAOYSA-N |