4-(2,5-dimethoxyanilino)-4-oxobutanoic acid
Chemical Structure Depiction of
4-(2,5-dimethoxyanilino)-4-oxobutanoic acid
4-(2,5-dimethoxyanilino)-4-oxobutanoic acid
Compound characteristics
Compound ID: | Y200-6082 |
Compound Name: | 4-(2,5-dimethoxyanilino)-4-oxobutanoic acid |
Molecular Weight: | 253.25 |
Molecular Formula: | C12 H15 N O5 |
Smiles: | COc1ccc(c(c1)NC(CCC(O)=O)=O)OC |
Stereo: | ACHIRAL |
logP: | 0.473 |
logD: | -2.4764 |
logSw: | -1.9316 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.248 |
InChI Key: | XQQBLMMDNXWGEB-UHFFFAOYSA-N |