(2S)-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid
Chemical Structure Depiction of
(2S)-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid
(2S)-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid
Compound characteristics
| Compound ID: | Y042-8508 |
| Compound Name: | (2S)-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid |
| Molecular Weight: | 381.38 |
| Molecular Formula: | C21 H19 N O6 |
| Smiles: | CC1=C(C)c2ccc(cc2OC1=O)OCC(N[C@H](C(O)=O)c1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8797 |
| logD: | -1.9946 |
| logSw: | -2.9726 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.619 |
| InChI Key: | URVDBVMHTCINRM-IBGZPJMESA-N |