6-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}hexanoic acid
Chemical Structure Depiction of
6-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}hexanoic acid
6-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}hexanoic acid
Compound characteristics
Compound ID: | Y040-8308 |
Compound Name: | 6-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}hexanoic acid |
Molecular Weight: | 417.5 |
Molecular Formula: | C23 H31 N O6 |
Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OC(C)C(NCCCCCC(O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.494 |
logD: | 0.6658 |
logSw: | -3.643 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 80.116 |
InChI Key: | POTRGKCAVYYTBF-INIZCTEOSA-N |