N-{[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}leucylvaline
Chemical Structure Depiction of
N-{[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}leucylvaline
N-{[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}leucylvaline
Compound characteristics
| Compound ID: | Y040-8463 |
| Compound Name: | N-{[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}leucylvaline |
| Molecular Weight: | 502.61 |
| Molecular Formula: | C27 H38 N2 O7 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OCC(N[C@@H](CC(C)C)C(N[C@@H](C(C)C)C(O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.159 |
| logD: | -0.4702 |
| logSw: | -3.433 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.463 |
| InChI Key: | YVSUSAHYHIZWGH-RDPSFJRHSA-N |