N-{[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-aspartic acid
Chemical Structure Depiction of
N-{[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-aspartic acid
N-{[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-aspartic acid
Compound characteristics
| Compound ID: | D715-0344 |
| Compound Name: | N-{[(4-ethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-aspartic acid |
| Molecular Weight: | 363.32 |
| Molecular Formula: | C17 H17 N O8 |
| Smiles: | CCC1=CC(=O)Oc2cc(ccc12)OCC(N[C@@H](CC(O)=O)C(O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.5958 |
| logD: | -4.6557 |
| logSw: | -2.4221 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.039 |
| InChI Key: | RFJFHCKYFVWREP-LBPRGKRZSA-N |