N-[(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-8-yl)methyl]-D-alanine
Chemical Structure Depiction of
N-[(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-8-yl)methyl]-D-alanine
N-[(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-8-yl)methyl]-D-alanine
Compound characteristics
| Compound ID: | Y040-4097 |
| Compound Name: | N-[(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-8-yl)methyl]-D-alanine |
| Molecular Weight: | 277.27 |
| Molecular Formula: | C14 H15 N O5 |
| Smiles: | CC1=CC(=O)Oc2c1ccc(c2CN[C@H](C)C(O)=O)O |
| Stereo: | ABSOLUTE |
| logP: | 0.4478 |
| logD: | -2.3089 |
| logSw: | -2.0937 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.278 |
| InChI Key: | PHJZJPUBGIRGCQ-MRVPVSSYSA-N |