Home Sulfos 1,3,5-Triazin-2-amine, 4-(4-fluoro-2-methoxyphenyl)-N-[3-[(S-methylsulfonimidoyl)methyl]phenyl]-

1,3,5-Triazin-2-amine, 4-(4-fluoro-2-methoxyphenyl)-N-[3-[(S-methylsulfonimidoyl)methyl]phenyl]-

CAS No.:
1414943-88-6
Catalog Number:
AG001GHG
Molecular Formula:
C18H18FN5O2S
Molecular Weight:
387.4312
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$821
- +
10mg
98%
1 week
United States
$1237
- +
Product Description
Catalog Number:
AG001GHG
Chemical Name:
1,3,5-Triazin-2-amine, 4-(4-fluoro-2-methoxyphenyl)-N-[3-[(S-methylsulfonimidoyl)methyl]phenyl]-
CAS Number:
1414943-88-6
Molecular Formula:
C18H18FN5O2S
Molecular Weight:
387.4312
MDL Number:
MFCD30502894
IUPAC Name:
4-(4-fluoro-2-methoxyphenyl)-N-[3-[(methylsulfonimidoyl)methyl]phenyl]-1,3,5-triazin-2-amine
InChI:
InChI=1S/C18H18FN5O2S/c1-26-16-9-13(19)6-7-15(16)17-21-11-22-18(24-17)23-14-5-3-4-12(8-14)10-27(2,20)25/h3-9,11,20H,10H2,1-2H3,(H,21,22,23,24)
InChI Key:
ACWKGTGIJRCOOM-UHFFFAOYSA-N
SMILES:
COc1cc(F)ccc1c1ncnc(n1)Nc1cccc(c1)CS(=O)(=N)C
Properties
Complexity:
588  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
387.117g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
387.433g/mol
Monoisotopic Mass:
387.117g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties