2-methyl-N-(2,2,2-trichloro-1-{[(4-sulfamoylphenyl)carbamothioyl]amino}ethyl)propanamide
Chemical Structure Depiction of
2-methyl-N-(2,2,2-trichloro-1-{[(4-sulfamoylphenyl)carbamothioyl]amino}ethyl)propanamide
2-methyl-N-(2,2,2-trichloro-1-{[(4-sulfamoylphenyl)carbamothioyl]amino}ethyl)propanamide
Compound characteristics
Compound ID: | 0687-1197 |
Compound Name: | 2-methyl-N-(2,2,2-trichloro-1-{[(4-sulfamoylphenyl)carbamothioyl]amino}ethyl)propanamide |
Molecular Weight: | 447.79 |
Molecular Formula: | C13 H17 Cl3 N4 O3 S2 |
Smiles: | CC(C)C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(cc1)S(N)(=O)=O)=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0111 |
logD: | 1.9024 |
logSw: | -2.7217 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 5 |
Polar surface area: | 94.234 |
InChI Key: | BYTWVXQLUDANSC-NSHDSACASA-N |