7'-hydroxy-8'-[(4-methylpiperazin-1-yl)methyl]-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione
Chemical Structure Depiction of
7'-hydroxy-8'-[(4-methylpiperazin-1-yl)methyl]-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione
7'-hydroxy-8'-[(4-methylpiperazin-1-yl)methyl]-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione
Compound characteristics
Compound ID: | G786-1893 |
Compound Name: | 7'-hydroxy-8'-[(4-methylpiperazin-1-yl)methyl]-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione |
Molecular Weight: | 418.45 |
Molecular Formula: | C24 H22 N2 O5 |
Smiles: | CN1CCN(CC1)Cc1c(ccc2C(=CC(=O)Oc12)C1=Cc2ccccc2OC1=O)O |
Stereo: | ACHIRAL |
logP: | 2.2557 |
logD: | 1.4568 |
logSw: | -2.9721 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.737 |
InChI Key: | OCCOMEQHDOXWES-UHFFFAOYSA-N |