5-hydroxy-4,7-dimethyl-6-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
5-hydroxy-4,7-dimethyl-6-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
5-hydroxy-4,7-dimethyl-6-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-3543 |
| Compound Name: | 5-hydroxy-4,7-dimethyl-6-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 302.37 |
| Molecular Formula: | C17 H22 N2 O3 |
| Smiles: | CC1=CC(=O)Oc2cc(C)c(CN3CCN(C)CC3)c(c12)O |
| Stereo: | ACHIRAL |
| logP: | 2.0025 |
| logD: | 1.2036 |
| logSw: | -2.0439 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.334 |
| InChI Key: | WGUZLTHKEOYMHQ-UHFFFAOYSA-N |