5,7-dimethyl-4-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
5,7-dimethyl-4-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
5,7-dimethyl-4-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3856 |
| Compound Name: | 5,7-dimethyl-4-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 286.37 |
| Molecular Formula: | C17 H22 N2 O2 |
| Smiles: | Cc1cc(C)c2C(CN3CCN(C)CC3)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 2.1083 |
| logD: | 0.9679 |
| logSw: | -2.4016 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 27.8549 |
| InChI Key: | GQFZLJRGKIQDLL-UHFFFAOYSA-N |