ethyl (3-chloro-4-cyanoanilino)(oxo)acetate
Chemical Structure Depiction of
ethyl (3-chloro-4-cyanoanilino)(oxo)acetate
ethyl (3-chloro-4-cyanoanilino)(oxo)acetate
Compound characteristics
Compound ID: | Y030-3607 |
Compound Name: | ethyl (3-chloro-4-cyanoanilino)(oxo)acetate |
Molecular Weight: | 252.65 |
Molecular Formula: | C11 H9 Cl N2 O3 |
Smiles: | CCOC(C(Nc1ccc(C#N)c(c1)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 2.2213 |
logD: | -0.367 |
logSw: | -3.5846 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.411 |
InChI Key: | JGXFUFZRWJXJCA-UHFFFAOYSA-N |