(2S)-{2-[(4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid
Chemical Structure Depiction of
(2S)-{2-[(4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid
(2S)-{2-[(4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid
Compound characteristics
| Compound ID: | Y042-8423 |
| Compound Name: | (2S)-{2-[(4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C22 H21 N O6 |
| Smiles: | CCC1=CC(=O)Oc2c1ccc(c2C)OCC(N[C@H](C(O)=O)c1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3457 |
| logD: | -1.5287 |
| logSw: | -3.1081 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.876 |
| InChI Key: | WTBPRYBJRCLLKP-HXUWFJFHSA-N |