methyl 2-({[2,2,2-trichloro-1-(4-methoxybenzamido)ethyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
methyl 2-({[2,2,2-trichloro-1-(4-methoxybenzamido)ethyl]carbamothioyl}amino)benzoate
methyl 2-({[2,2,2-trichloro-1-(4-methoxybenzamido)ethyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | 1503-0973 |
| Compound Name: | methyl 2-({[2,2,2-trichloro-1-(4-methoxybenzamido)ethyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 490.79 |
| Molecular Formula: | C19 H18 Cl3 N3 O4 S |
| Smiles: | COC(c1ccccc1NC(NC(C([Cl])([Cl])[Cl])NC(c1ccc(cc1)OC)=O)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1083 |
| logD: | 3.5581 |
| logSw: | -4.6065 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.38 |
| InChI Key: | FTYOGKYRVVKJJH-KRWDZBQOSA-N |