(2S)-{2-[(8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid
Chemical Structure Depiction of
(2S)-{2-[(8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid
(2S)-{2-[(8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid
Compound characteristics
| Compound ID: | Y042-8457 |
| Compound Name: | (2S)-{2-[(8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetamido}(phenyl)acetic acid |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C23 H23 N O6 |
| Smiles: | CCCC1=CC(=O)Oc2c1ccc(c2C)OCC(N[C@H](C(O)=O)c1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8587 |
| logD: | -1.0157 |
| logSw: | -3.3853 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.876 |
| InChI Key: | PBKLZGWBZVBQNV-OAQYLSRUSA-N |