3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y507-2475 |
| Compound Name: | 3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 258.72 |
| Molecular Formula: | C7 H12 F2 N4 S |
| Salt: | HCl |
| Smiles: | CCCCSc1nnc(C(F)F)n1N |
| Stereo: | ACHIRAL |
| logP: | 1.3935 |
| logD: | 1.3935 |
| logSw: | -1.3575 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.682 |
| InChI Key: | QWKXFWOAZSFOTR-UHFFFAOYSA-N |