3-(3,4-dimethoxyphenyl)-7-hydroxy-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-7-hydroxy-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-4H-1-benzopyran-4-one
3-(3,4-dimethoxyphenyl)-7-hydroxy-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 6737-1163 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-7-hydroxy-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-4H-1-benzopyran-4-one |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C24 H28 N2 O5 |
| Smiles: | CC1=C(C(c2ccc(c(CN3CCN(C)CC3)c2O1)O)=O)c1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.503 |
| logD: | 1.7041 |
| logSw: | -2.9035 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.028 |
| InChI Key: | ZWFNWOXAYYWPMF-UHFFFAOYSA-N |