6-{2-[(3,4,7-trimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]propanamido}hexanoic acid
Chemical Structure Depiction of
6-{2-[(3,4,7-trimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]propanamido}hexanoic acid
6-{2-[(3,4,7-trimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]propanamido}hexanoic acid
Compound characteristics
| Compound ID: | Y040-8332 |
| Compound Name: | 6-{2-[(3,4,7-trimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]propanamido}hexanoic acid |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C21 H27 N O6 |
| Smiles: | CC(C(NCCCCCC(O)=O)=O)Oc1cc(C)cc2c1C(C)=C(C)C(=O)O2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8097 |
| logD: | -0.0184 |
| logSw: | -2.9789 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.946 |
| InChI Key: | PDSVDASCOOWDRM-HNNXBMFYSA-N |