6-{2-[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}hexanoic acid
Chemical Structure Depiction of
6-{2-[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}hexanoic acid
6-{2-[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}hexanoic acid
Compound characteristics
Compound ID: | Y040-8245 |
Compound Name: | 6-{2-[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}hexanoic acid |
Molecular Weight: | 375.42 |
Molecular Formula: | C20 H25 N O6 |
Smiles: | CCC1=CC(=O)Oc2cc(ccc12)OC(C)C(NCCCCCC(O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.7632 |
logD: | -1.065 |
logSw: | -2.5022 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 80.345 |
InChI Key: | AVZXMDYUSXVSHG-ZDUSSCGKSA-N |