3-chloro-N-(2,2,2-trichloro-1-{[(5-chloropyridin-2-yl)carbamothioyl]amino}ethyl)benzamide
Chemical Structure Depiction of
3-chloro-N-(2,2,2-trichloro-1-{[(5-chloropyridin-2-yl)carbamothioyl]amino}ethyl)benzamide
3-chloro-N-(2,2,2-trichloro-1-{[(5-chloropyridin-2-yl)carbamothioyl]amino}ethyl)benzamide
Compound characteristics
Compound ID: | 1309-1197 |
Compound Name: | 3-chloro-N-(2,2,2-trichloro-1-{[(5-chloropyridin-2-yl)carbamothioyl]amino}ethyl)benzamide |
Molecular Weight: | 472.61 |
Molecular Formula: | C15 H11 Cl5 N4 O S |
Smiles: | c1cc(cc(c1)[Cl])C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(cn1)[Cl])=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.2144 |
logD: | 4.0001 |
logSw: | -5.6942 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 53.064 |
InChI Key: | QWXFZLGZAMVASW-ZDUSSCGKSA-N |