N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 4085-0039 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 336.72 |
| Molecular Formula: | C11 H8 Cl F3 N4 O S |
| Smiles: | C(C(Nc1cc(ccc1[Cl])C(F)(F)F)=O)Sc1nnc[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.9641 |
| logD: | 1.6096 |
| logSw: | -2.9382 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.844 |
| InChI Key: | PRCXQKPEUUWGDH-UHFFFAOYSA-N |