N-{[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-5-hydroxytryptophan
Chemical Structure Depiction of
N-{[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-5-hydroxytryptophan
N-{[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-5-hydroxytryptophan
Compound characteristics
| Compound ID: | Y041-2269 |
| Compound Name: | N-{[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-5-hydroxytryptophan |
| Molecular Weight: | 478.5 |
| Molecular Formula: | C26 H26 N2 O7 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(ccc12)OCC(NC(Cc1c[nH]c2ccc(cc12)O)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2907 |
| logD: | -1.2999 |
| logSw: | -2.9474 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 107.871 |
| InChI Key: | PILODEJWJAFZST-QFIPXVFZSA-N |