(2RS)-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}(phenyl)acetic acid
Chemical Structure Depiction of
(2RS)-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}(phenyl)acetic acid
(2RS)-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}(phenyl)acetic acid
Compound characteristics
| Compound ID: | Y042-8501 |
| Compound Name: | (2RS)-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}(phenyl)acetic acid |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C25 H27 N O6 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OC(C)C(N[C@H](C(O)=O)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9547 |
| logD: | 0.0803 |
| logSw: | -3.978 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.379 |
| InChI Key: | RVDSMTWQSNUNLV-VXNXSFHZSA-N |