N-{4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl}-2-[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-{4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl}-2-[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide--hydrogen chloride (1/1)
N-{4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl}-2-[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 6208-0449 |
| Compound Name: | N-{4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl}-2-[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide--hydrogen chloride (1/1) |
| Molecular Weight: | 620.58 |
| Molecular Formula: | C26 H26 Cl N7 O3 S2 |
| Salt: | HCl |
| Smiles: | C1CCC(CC1)n1c(c2ccccc2)nnc1SCC(Nc1ccc(cc1)S(Nc1ccc(nn1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2047 |
| logD: | 2.3608 |
| logSw: | -4.4499 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.522 |
| InChI Key: | VKHGVDPDGWSRMI-UHFFFAOYSA-N |