4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-2-(4-methylphenyl)propanoyl]amino]benzenesulfonyl fluoride; ethanesulfonic acid

Modify Date: 2025-08-29 12:06:24

4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-2-(4-methylphenyl)propanoyl]amino]benzenesulfonyl fluoride; ethanesulfonic acid Structure
4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-2-(4-methylphenyl)propanoyl]amino]benzenesulfonyl fluoride; ethanesulfonic acid structure
Common Name 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-2-(4-methylphenyl)propanoyl]amino]benzenesulfonyl fluoride; ethanesulfonic acid
CAS Number 21316-40-5 Molecular Weight 646.75300
Density N/A Boiling Point N/A
Molecular Formula C29H35FN6O6S2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 4-[[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-2-(4-methylphenyl)propanoyl]amino]benzenesulfonyl fluoride,ethanesulfonic acid

 Chemical & Physical Properties

Molecular Formula C29H35FN6O6S2
Molecular Weight 646.75300
Exact Mass 646.20400
PSA 214.37000
LogP 6.26920
InChIKey HVUKIUQLGRXIOP-UHFFFAOYSA-N
SMILES CCS(=O)(=O)O.Cc1ccc(C(Cc2ccc(N3C(N)=NC(N)=NC3(C)C)cc2)C(=O)Nc2ccc(S(=O)(=O)F)cc2)cc1
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