ethyl 4-(2-{[5-(4-chlorophenyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[5-(4-chlorophenyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[5-(4-chlorophenyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
Compound ID: | F342-0126 |
Compound Name: | ethyl 4-(2-{[5-(4-chlorophenyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate |
Molecular Weight: | 429.92 |
Molecular Formula: | C21 H20 Cl N3 O3 S |
Smiles: | CCOC(c1ccc(cc1)NC(CSc1ncc(c2ccc(cc2)[Cl])n1C)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.1685 |
logD: | 5.1632 |
logSw: | -5.6471 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.476 |
InChI Key: | DVQFLSAHJOWSDP-UHFFFAOYSA-N |