2-Chloro-4-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid

Base Information

• Chemical Name: 2-Chloro-4-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
• CAS No.: 20092-08-4
• Molecular Formula: C21H26Cl2FN7O6S2
• Molecular Weight: 626.5088
• NSC Number: 123465
• DSSTox Substance ID: DTXSID70298492

Synonyms:20092-08-4;NSC123465;DTXSID70298492;NSC-123465;Ethanesulfonic acid--2-chloro-4-[({[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenyl]methyl}carbamoyl)amino]benzene-1-sulfonyl fluoride (1/1)

Chemical Property of 2-Chloro-4-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid

Chemical Property:

• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 6
• Exact Mass: 625.0747075
• Heavy Atom Count: 39
• Complexity: 1020

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC(=C(C=C2)CNC(=O)NC3=CC(=C(C=C3)S(=O)(=O)F)Cl)Cl)N)N)C

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