N-[(7-hydroxy-2-oxo-4-phenyl-2H-1-benzopyran-8-yl)methyl]isoleucine
Chemical Structure Depiction of
N-[(7-hydroxy-2-oxo-4-phenyl-2H-1-benzopyran-8-yl)methyl]isoleucine
N-[(7-hydroxy-2-oxo-4-phenyl-2H-1-benzopyran-8-yl)methyl]isoleucine
Compound characteristics
| Compound ID: | Y040-8228 |
| Compound Name: | N-[(7-hydroxy-2-oxo-4-phenyl-2H-1-benzopyran-8-yl)methyl]isoleucine |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C22 H23 N O5 |
| Smiles: | CC[C@H](C)[C@H](C(O)=O)NCc1c(ccc2C(=CC(=O)Oc12)c1ccccc1)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9617 |
| logD: | -0.7336 |
| logSw: | -2.7941 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.195 |
| InChI Key: | DWLSLOKNTKMQTC-XCLFUZPHSA-N |