N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-beta-alanine
Chemical Structure Depiction of
N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-beta-alanine
N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-beta-alanine
Compound characteristics
| Compound ID: | Y041-1727 |
| Compound Name: | N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-beta-alanine |
| Molecular Weight: | 357.36 |
| Molecular Formula: | C19 H19 N O6 |
| Smiles: | CC1=C(CC(NCCC(O)=O)=O)C(=O)Oc2c1cc1c(C)coc1c2C |
| Stereo: | ACHIRAL |
| logP: | 1.333 |
| logD: | -1.3627 |
| logSw: | -2.0112 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.334 |
| InChI Key: | VFLFJMWKFCJVGJ-UHFFFAOYSA-N |