3-(4-chlorophenyl)-7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-4H-1-benzopyran-4-one
3-(4-chlorophenyl)-7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | Y041-2742 |
| Compound Name: | 3-(4-chlorophenyl)-7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-4H-1-benzopyran-4-one |
| Molecular Weight: | 414.89 |
| Molecular Formula: | C22 H23 Cl N2 O4 |
| Smiles: | C1CN(CCN1CCO)Cc1c(ccc2C(C(=COc12)c1ccc(cc1)[Cl])=O)O |
| Stereo: | ACHIRAL |
| logP: | 2.5595 |
| logD: | 2.0636 |
| logSw: | -3.3612 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.271 |
| InChI Key: | FYQSUVUWJCYYDI-UHFFFAOYSA-N |