N-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}tryptophan
Chemical Structure Depiction of
N-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}tryptophan
N-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}tryptophan
Compound characteristics
| Compound ID: | Y040-8315 |
| Compound Name: | N-{2-[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}tryptophan |
| Molecular Weight: | 490.56 |
| Molecular Formula: | C28 H30 N2 O6 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OC(C)C(N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9591 |
| logD: | 0.3685 |
| logSw: | -3.8727 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.528 |
| InChI Key: | MYVZFRIIUFAZIR-VXLWULRPSA-N |