N-[(5-hydroxy-7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-6-yl)methyl]isoleucine
Chemical Structure Depiction of
N-[(5-hydroxy-7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-6-yl)methyl]isoleucine
N-[(5-hydroxy-7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-6-yl)methyl]isoleucine
Compound characteristics
| Compound ID: | Y040-8232 |
| Compound Name: | N-[(5-hydroxy-7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-6-yl)methyl]isoleucine |
| Molecular Weight: | 395.45 |
| Molecular Formula: | C23 H25 N O5 |
| Smiles: | CC[C@@H](C)[C@H](C(O)=O)NCc1c(C)cc2c(C(=CC(=O)O2)c2ccccc2)c1O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5824 |
| logD: | -0.1129 |
| logSw: | -2.8162 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.442 |
| InChI Key: | IJFCFMROTGGCBB-ZSEKCTLFSA-N |