N-{2-[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}tryptophan
Chemical Structure Depiction of
N-{2-[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}tryptophan
N-{2-[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}tryptophan
Compound characteristics
| Compound ID: | Y040-8294 |
| Compound Name: | N-{2-[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}tryptophan |
| Molecular Weight: | 476.53 |
| Molecular Formula: | C27 H28 N2 O6 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(ccc12)OC(C)C(N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2215 |
| logD: | -0.3691 |
| logSw: | -3.4719 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.757 |
| InChI Key: | CDZRYNQLEUMRFT-KESSSICBSA-N |