4-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}butanoic acid
Chemical Structure Depiction of
4-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}butanoic acid
4-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}butanoic acid
Compound characteristics
| Compound ID: | D715-0462 |
| Compound Name: | 4-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}butanoic acid |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C18 H21 N O6 |
| Smiles: | CC(C(NCCCC(O)=O)=O)Oc1ccc2C(C)=C(C)C(=O)Oc2c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2084 |
| logD: | -1.6125 |
| logSw: | -2.229 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.859 |
| InChI Key: | HSMWYUIMHNQKPN-LBPRGKRZSA-N |