N-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-beta-alanine
Chemical Structure Depiction of
N-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-beta-alanine
N-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-beta-alanine
Compound characteristics
| Compound ID: | Y043-8757 |
| Compound Name: | N-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-beta-alanine |
| Molecular Weight: | 371.39 |
| Molecular Formula: | C20 H21 N O6 |
| Smiles: | CC1=C(CC(NCCC(O)=O)=O)C(=O)Oc2c1cc1c(C)c(C)oc1c2C |
| Stereo: | ACHIRAL |
| logP: | 1.7125 |
| logD: | -0.9832 |
| logSw: | -2.2001 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.722 |
| InChI Key: | BQFGRZXOYSPLJW-UHFFFAOYSA-N |