N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-N'-[2-(trifluoromethoxy)phenyl]urea
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-N'-[2-(trifluoromethoxy)phenyl]urea
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-N'-[2-(trifluoromethoxy)phenyl]urea
Compound characteristics
| Compound ID: | Y044-5214 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-N'-[2-(trifluoromethoxy)phenyl]urea |
| Molecular Weight: | 424.44 |
| Molecular Formula: | C19 H19 F3 N4 O2 S |
| Smiles: | CSCC[C@@H](c1nc2ccccc2[nH]1)NC(Nc1ccccc1OC(F)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 4.3476 |
| logD: | 4.3468 |
| logSw: | -4.4499 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 58.111 |
| InChI Key: | QHKWFSKSADJKOT-HNNXBMFYSA-N |