8'-[(4-ethylpiperazin-1-yl)methyl]-7'-hydroxy-8-methoxy-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione
Chemical Structure Depiction of
8'-[(4-ethylpiperazin-1-yl)methyl]-7'-hydroxy-8-methoxy-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione
8'-[(4-ethylpiperazin-1-yl)methyl]-7'-hydroxy-8-methoxy-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione
Compound characteristics
Compound ID: | G786-1902 |
Compound Name: | 8'-[(4-ethylpiperazin-1-yl)methyl]-7'-hydroxy-8-methoxy-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione |
Molecular Weight: | 462.5 |
Molecular Formula: | C26 H26 N2 O6 |
Smiles: | CCN1CCN(CC1)Cc1c(ccc2C(=CC(=O)Oc12)C1=Cc2cccc(c2OC1=O)OC)O |
Stereo: | ACHIRAL |
logP: | 2.5493 |
logD: | 1.6176 |
logSw: | -2.8242 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.112 |
InChI Key: | HMMOLERIPRANRY-UHFFFAOYSA-N |