N-[(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]isoleucine
Chemical Structure Depiction of
N-[(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]isoleucine
N-[(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]isoleucine
Compound characteristics
| Compound ID: | Y041-2377 |
| Compound Name: | N-[(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]isoleucine |
| Molecular Weight: | 375.42 |
| Molecular Formula: | C20 H25 N O6 |
| Smiles: | CC[C@H](C)[C@H](C(O)=O)NC(CC1=C(C)c2ccc(c(C)c2OC1=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.767 |
| logD: | -1.8202 |
| logSw: | -2.5725 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.706 |
| InChI Key: | UVVGZQXJIPLQFR-QGHHPUGFSA-N |