N-{[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-tryptophan
Chemical Structure Depiction of
N-{[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-tryptophan
N-{[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-tryptophan
Compound characteristics
| Compound ID: | Y040-8289 |
| Compound Name: | N-{[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-tryptophan |
| Molecular Weight: | 462.5 |
| Molecular Formula: | C26 H26 N2 O6 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(ccc12)OCC(N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.9706 |
| logD: | -0.62 |
| logSw: | -3.3109 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.254 |
| InChI Key: | XHKLMINRCMVECU-QFIPXVFZSA-N |