6-[2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetamido]hexanoic acid
Chemical Structure Depiction of
6-[2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetamido]hexanoic acid
6-[2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetamido]hexanoic acid
Compound characteristics
| Compound ID: | Y041-2388 |
| Compound Name: | 6-[2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetamido]hexanoic acid |
| Molecular Weight: | 395.84 |
| Molecular Formula: | C19 H22 Cl N O6 |
| Smiles: | CC1=C(CC(NCCCCCC(O)=O)=O)C(=O)Oc2cc(c(cc12)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 2.2322 |
| logD: | -0.596 |
| logSw: | -3.1213 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.487 |
| InChI Key: | VXMBDOPQAJZXDG-UHFFFAOYSA-N |