methyl N-[(3,5-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-L-phenylalaninate
Chemical Structure Depiction of
methyl N-[(3,5-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-L-phenylalaninate
methyl N-[(3,5-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-L-phenylalaninate
Compound characteristics
| Compound ID: | Y041-4918 |
| Compound Name: | methyl N-[(3,5-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-L-phenylalaninate |
| Molecular Weight: | 433.46 |
| Molecular Formula: | C25 H23 N O6 |
| Smiles: | CC1=C(CC(N[C@@H](Cc2ccccc2)C(=O)OC)=O)C(=O)Oc2cc3c(cc12)c(C)co3 |
| Stereo: | ABSOLUTE |
| logP: | 3.5451 |
| logD: | 3.5451 |
| logSw: | -3.8282 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.724 |
| InChI Key: | BQGYNZINSLANGQ-FQEVSTJZSA-N |