2-[2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetamido]butanoic acid
Chemical Structure Depiction of
2-[2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetamido]butanoic acid
2-[2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetamido]butanoic acid
Compound characteristics
| Compound ID: | Y040-4028 |
| Compound Name: | 2-[2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)acetamido]butanoic acid |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C17 H19 N O6 |
| Smiles: | CCC(C(O)=O)NC(CC1=C(C)c2ccc(c(C)c2OC1=O)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9331 |
| logD: | -2.6848 |
| logSw: | -2.2897 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.902 |
| InChI Key: | DGTCRFIPTQTOCR-LBPRGKRZSA-N |