N-{4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl}-2-[(4-ethyl-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-ethyl-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-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | 6208-0450 |
Compound Name: | N-{4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl}-2-[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide--hydrogen chloride (1/1) |
Molecular Weight: | 566.49 |
Molecular Formula: | C22 H20 Cl N7 O3 S2 |
Salt: | HCl |
Smiles: | CCn1c(c2ccccc2)nnc1SCC(Nc1ccc(cc1)S(Nc1ccc(nn1)[Cl])(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9485 |
logD: | 1.1046 |
logSw: | -3.7486 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 109.941 |
InChI Key: | PFXUZVVVGKTLCD-UHFFFAOYSA-N |