Home Sulfos 1-methyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-sulfonyl chloride

1-methyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-sulfonyl chloride

CAS No.:
1251923-69-9
Catalog Number:
AG01AA4A
Molecular Formula:
C8H6ClN3O4S
Molecular Weight:
275.6689
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Product Description
Catalog Number:
AG01AA4A
Chemical Name:
1-methyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-6-sulfonyl chloride
CAS Number:
1251923-69-9
Molecular Formula:
C8H6ClN3O4S
Molecular Weight:
275.6689
MDL Number:
MFCD16817564
IUPAC Name:
1-methyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-sulfonyl chloride
InChI:
InChI=1S/C8H6ClN3O4S/c1-12-6-5(7(13)11-8(12)14)2-4(3-10-6)17(9,15)16/h2-3H,1H3,(H,11,13,14)
InChI Key:
FHJPNZYMEGEHKE-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(=O)n(c2c1cc(cn2)S(=O)(=O)Cl)C
Properties
Complexity:
460  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.977g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
275.663g/mol
Monoisotopic Mass:
274.977g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties