N-(2,2,2-trichloro-1-{[(2,4-dimethylphenyl)carbamothioyl]amino}ethyl)benzamide
Chemical Structure Depiction of
N-(2,2,2-trichloro-1-{[(2,4-dimethylphenyl)carbamothioyl]amino}ethyl)benzamide
N-(2,2,2-trichloro-1-{[(2,4-dimethylphenyl)carbamothioyl]amino}ethyl)benzamide
Compound characteristics
| Compound ID: | 0318-0005 |
| Compound Name: | N-(2,2,2-trichloro-1-{[(2,4-dimethylphenyl)carbamothioyl]amino}ethyl)benzamide |
| Molecular Weight: | 430.78 |
| Molecular Formula: | C18 H18 Cl3 N3 O S |
| Smiles: | Cc1ccc(c(C)c1)NC(NC(C([Cl])([Cl])[Cl])NC(c1ccccc1)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7789 |
| logD: | 3.9911 |
| logSw: | -4.8684 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 42.662 |
| InChI Key: | ZSXIKEGUNOZZJM-INIZCTEOSA-N |