N-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]-L-valine
Chemical Structure Depiction of
N-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]-L-valine
N-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]-L-valine
Compound characteristics
| Compound ID: | Y042-9574 |
| Compound Name: | N-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]-L-valine |
| Molecular Weight: | 381.81 |
| Molecular Formula: | C18 H20 Cl N O6 |
| Smiles: | CC(C)[C@@H](C(O)=O)NC(CCC1=C(C)c2cc(c(cc2OC1=O)O)[Cl])=O |
| Stereo: | ABSOLUTE |
| logP: | 1.5426 |
| logD: | -2.0445 |
| logSw: | -2.5807 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.94 |
| InChI Key: | QOLLHVWXVJIFRI-INIZCTEOSA-N |