N-[3-(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]-L-valine
Chemical Structure Depiction of
N-[3-(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]-L-valine
N-[3-(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]-L-valine
Compound characteristics
| Compound ID: | Y042-9393 |
| Compound Name: | N-[3-(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]-L-valine |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C18 H21 N O6 |
| Smiles: | CC(C)[C@@H](C(O)=O)NC(CCC1=C(C)c2ccc(cc2OC1=O)O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.4832 |
| logD: | -3.1039 |
| logSw: | -2.2028 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.009 |
| InChI Key: | CWMLRUNGSXECOH-INIZCTEOSA-N |