AC1L5UOV

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

Also Known As: ethanesulfonic acid- 4-chloro-3-{[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]methyl}benzenesulfonyl fluoride(1:1)|4-chloro-3-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-tria|4-chloro-3-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]methyl]benzenesulfonyl fluoride|4-chloro-3-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]methyl]benzenesulfonyl fluoride; ethanesulfonic acid|Ethanesulfonic acid--4-chloro-3-{[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenoxy]methyl}benzene-1-sulfonyl fluoride (1/1)|Ethanesulfonic acid-4-chloro-3-{[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenoxy]methyl}benzenesulfonyl fluoride(1:1)

Molecular Formula	C20H24Cl2FN5O6S2
Molecular Weight	583.0529 g/mol
LogP	3.3102
Topological Polar Surface Area	195.0 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	583.0529
Monoisotopic Mass	583.0529
Heavy Atoms	36
Complexity	909.0

Chemical Identifiers

CAS Number	3132-27-2
SMILES	CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC(=C(C=C2)OCC3=C(C=CC(=C3)S(=O)(=O)F)Cl)Cl)N)N)C
InChIKey	MIWAYGVTUKWJKN-UHFFFAOYSA-N