N-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]glycyl-L-valine
Chemical Structure Depiction of
N-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]glycyl-L-valine
N-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]glycyl-L-valine
Compound characteristics
| Compound ID: | Y042-9585 |
| Compound Name: | N-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]glycyl-L-valine |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C21 H26 N2 O7 |
| Smiles: | CC(C)[C@@H](C(O)=O)NC(CNC(CCC1=C(C)c2ccc(c(C)c2OC1=O)O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.7189 |
| logD: | -2.9103 |
| logSw: | -2.1528 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 114.096 |
| InChI Key: | JXWHSYHGZNFBOB-SFHVURJKSA-N |