4-[3-[3-(4,6-Diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]propanoylamino]benzenesulfonyl fluoride; ethanesulfonic acid

Base Information

• Chemical Name: 4-[3-[3-(4,6-Diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]propanoylamino]benzenesulfonyl fluoride; ethanesulfonic acid
• CAS No.: 19174-29-9
• Molecular Formula: C22H29FN6O6S2
• Molecular Weight: 556.6307
• NSC Number: 113907
• DSSTox Substance ID: DTXSID00297074
• Mol file: 19174-29-9.mol

Synonyms:NSC113907;19174-29-9;4-[3-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]propanoylamino]benzenesulfonyl fluoride;ethanesulfonic acid;DTXSID00297074;NSC-113907;1-[((4-Fluorosulfonyl-phenylaminocarbonyl)ethylene)phen-3-yl]-4,6-

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

Chemical Property:

• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 556.15740318
• Heavy Atom Count: 37
• Complexity: 936

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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