N,N-dimethyl-N'-(2,2,2-trichloro-1-{[(3,4-dichlorophenyl)carbamothioyl]amino}ethyl)urea
Chemical Structure Depiction of
N,N-dimethyl-N'-(2,2,2-trichloro-1-{[(3,4-dichlorophenyl)carbamothioyl]amino}ethyl)urea
N,N-dimethyl-N'-(2,2,2-trichloro-1-{[(3,4-dichlorophenyl)carbamothioyl]amino}ethyl)urea
Compound characteristics
| Compound ID: | 0319-0112 |
| Compound Name: | N,N-dimethyl-N'-(2,2,2-trichloro-1-{[(3,4-dichlorophenyl)carbamothioyl]amino}ethyl)urea |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C12 H13 Cl5 N4 O S |
| Smiles: | CN(C)C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(c(c1)[Cl])[Cl])=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2532 |
| logD: | 4.2272 |
| logSw: | -4.5023 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 45.09 |
| InChI Key: | ROLHJKDTIPXOFL-VIFPVBQESA-N |