N-(4-chlorophenyl)-N'-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}thiourea
Chemical Structure Depiction of
N-(4-chlorophenyl)-N'-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}thiourea
N-(4-chlorophenyl)-N'-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}thiourea
Compound characteristics
| Compound ID: | 8010-5556 |
| Compound Name: | N-(4-chlorophenyl)-N'-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}thiourea |
| Molecular Weight: | 418.82 |
| Molecular Formula: | C16 H14 Cl F3 N4 O2 S |
| Smiles: | C(CNc1ccc(cc1[N+]([O-])=O)C(F)(F)F)NC(Nc1ccc(cc1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 4.5524 |
| logD: | 4.5524 |
| logSw: | -4.8466 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.955 |
| InChI Key: | GEAZKGMRRIJGPK-UHFFFAOYSA-N |