N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[5-(1H-indol-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[5-(1H-indol-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[5-(1H-indol-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | C592-2405 |
Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[5-(1H-indol-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
Molecular Weight: | 465.88 |
Molecular Formula: | C20 H15 Cl F3 N5 O S |
Smiles: | Cn1c(c2c[nH]c3ccccc23)nnc1SCC(Nc1cc(ccc1[Cl])C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 4.5702 |
logD: | 4.5375 |
logSw: | -4.5668 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.373 |
InChI Key: | CTHQEXXXXMVKIY-UHFFFAOYSA-N |