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Home Sulfos 4-(4-Fluorophenyl)-6-isopropyl-2-(n-methyl-n-methylsulfonylamino)pyrimidine-5-carboxaldehyde

4-(4-Fluorophenyl)-6-isopropyl-2-(n-methyl-n-methylsulfonylamino)pyrimidine-5-carboxaldehyde

CAS No.:
147118-37-4
Catalog Number:
AG001EN1
Molecular Formula:
C16H18FN3O3S
Molecular Weight:
351.3958
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(HPLC)(N)
1 week
United States
$80
- +
25g
>98.0%(HPLC)(N)
1 week
United States
$167
- +
Product Description
Catalog Number:
AG001EN1
Chemical Name:
4-(4-Fluorophenyl)-6-isopropyl-2-(n-methyl-n-methylsulfonylamino)pyrimidine-5-carboxaldehyde
CAS Number:
147118-37-4
Molecular Formula:
C16H18FN3O3S
Molecular Weight:
351.3958
MDL Number:
MFCD08458342
IUPAC Name:
N-[4-(4-fluorophenyl)-5-formyl-6-propan-2-ylpyrimidin-2-yl]-N-methylmethanesulfonamide
InChI:
InChI=1S/C16H18FN3O3S/c1-10(2)14-13(9-21)15(11-5-7-12(17)8-6-11)19-16(18-14)20(3)24(4,22)23/h5-10H,1-4H3
InChI Key:
WOCOTUDOVSLFOB-UHFFFAOYSA-N
SMILES:
O=Cc1c(nc(nc1C(C)C)N(S(=O)(=O)C)C)c1ccc(cc1)F
EC Number:
604-564-4
Properties
Complexity:
529  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.105g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.396g/mol
Monoisotopic Mass:
351.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
88.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties