(2S)-[2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetamido](phenyl)acetic acid
Chemical Structure Depiction of
(2S)-[2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetamido](phenyl)acetic acid
(2S)-[2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetamido](phenyl)acetic acid
Compound characteristics
| Compound ID: | Y040-4419 |
| Compound Name: | (2S)-[2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetamido](phenyl)acetic acid |
| Molecular Weight: | 381.38 |
| Molecular Formula: | C21 H19 N O6 |
| Smiles: | CC1=C(CC(N[C@H](C(O)=O)c2ccccc2)=O)C(=O)Oc2cc(C)cc(c12)O |
| Stereo: | ABSOLUTE |
| logP: | 2.2362 |
| logD: | -1.6381 |
| logSw: | -2.8486 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.668 |
| InChI Key: | JKTAMJMOMNPXKG-LJQANCHMSA-N |