N-[(7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-alanine
Chemical Structure Depiction of
N-[(7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-alanine
N-[(7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-alanine
Compound characteristics
| Compound ID: | Y041-5404 |
| Compound Name: | N-[(7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-alanine |
| Molecular Weight: | 319.31 |
| Molecular Formula: | C16 H17 N O6 |
| Smiles: | CC1=C(CC(N[C@H](C)C(O)=O)=O)C(=O)Oc2cc(ccc12)OC |
| Stereo: | ABSOLUTE |
| logP: | 0.6305 |
| logD: | -3.0182 |
| logSw: | -2.2128 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.747 |
| InChI Key: | LLEKBVVXGVUUND-VIFPVBQESA-N |