3-(3,4-dimethoxyphenyl)-7-hydroxy-4-methyl-8-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-7-hydroxy-4-methyl-8-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
3-(3,4-dimethoxyphenyl)-7-hydroxy-4-methyl-8-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | G786-1946 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-7-hydroxy-4-methyl-8-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C24 H28 N2 O5 |
| Smiles: | CC1=C(C(=O)Oc2c1ccc(c2CN1CCN(C)CC1)O)c1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7588 |
| logD: | 1.9598 |
| logSw: | -3.006 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.591 |
| InChI Key: | HTPKUYIVVHEAGQ-UHFFFAOYSA-N |