1-(4-bromothiophen-2-yl)-N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
Chemical Structure Depiction of
1-(4-bromothiophen-2-yl)-N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
1-(4-bromothiophen-2-yl)-N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
Compound characteristics
| Compound ID: | Y508-8895 |
| Compound Name: | 1-(4-bromothiophen-2-yl)-N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine |
| Molecular Weight: | 353.21 |
| Molecular Formula: | C9 H7 Br F2 N4 S2 |
| Smiles: | CSc1nnc(C(F)F)n1/N=C/c1cc(cs1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.8222 |
| logD: | 2.8222 |
| logSw: | -2.9347 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.895 |
| InChI Key: | MDTVMCNCUFYZNI-UHFFFAOYSA-N |