N-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetyl}-L-aspartic acid
Chemical Structure Depiction of
N-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetyl}-L-aspartic acid
N-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetyl}-L-aspartic acid
Compound characteristics
| Compound ID: | Y042-8444 |
| Compound Name: | N-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]acetyl}-L-aspartic acid |
| Molecular Weight: | 377.35 |
| Molecular Formula: | C18 H19 N O8 |
| Smiles: | CCCC1=CC(=O)Oc2cc(ccc12)OCC(N[C@@H](CC(O)=O)C(O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.0828 |
| logD: | -4.1427 |
| logSw: | -2.3412 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.039 |
| InChI Key: | JOTJLAPXBZGPKF-ZDUSSCGKSA-N |