ethyl (1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)carbamate
Chemical Structure Depiction of
ethyl (1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)carbamate
ethyl (1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)carbamate
Compound characteristics
| Compound ID: | 0318-0109 |
| Compound Name: | ethyl (1-{[(3-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)carbamate |
| Molecular Weight: | 449.58 |
| Molecular Formula: | C12 H13 Br Cl3 N3 O2 S |
| Smiles: | CCOC(NC(C([Cl])([Cl])[Cl])NC(Nc1cccc(c1)[Br])=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4691 |
| logD: | 4.1555 |
| logSw: | -4.3332 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 51.712 |
| InChI Key: | XDGNGDBLWAHFOW-VIFPVBQESA-N |