2-anilino-2-oxoethyl ({1-[(4-chlorophenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
2-anilino-2-oxoethyl ({1-[(4-chlorophenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
2-anilino-2-oxoethyl ({1-[(4-chlorophenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate
Compound characteristics
Compound ID: | D425-2001 |
Compound Name: | 2-anilino-2-oxoethyl ({1-[(4-chlorophenyl)methyl]-1H-benzimidazol-2-yl}sulfanyl)acetate |
Molecular Weight: | 465.96 |
Molecular Formula: | C24 H20 Cl N3 O3 S |
Smiles: | C(c1ccc(cc1)[Cl])n1c2ccccc2nc1SCC(=O)OCC(Nc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 5.5301 |
logD: | 5.5036 |
logSw: | -5.9989 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.161 |
InChI Key: | ARUOFJUTCBQRRW-UHFFFAOYSA-N |