Home Halogens 5-chloro-2-(methylsulfanyl)pyrimidine-4-carboxamide

5-chloro-2-(methylsulfanyl)pyrimidine-4-carboxamide

CAS No.:
902243-56-5
Catalog Number:
AG01B7MX
Molecular Formula:
C6H6ClN3OS
Molecular Weight:
203.6493
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Product Description
Catalog Number:
AG01B7MX
Chemical Name:
5-chloro-2-(methylsulfanyl)pyrimidine-4-carboxamide
CAS Number:
902243-56-5
Molecular Formula:
C6H6ClN3OS
Molecular Weight:
203.6493
MDL Number:
MFCD08744823
IUPAC Name:
5-chloro-2-methylsulfanylpyrimidine-4-carboxamide
InChI:
InChI=1S/C6H6ClN3OS/c1-12-6-9-2-3(7)4(10-6)5(8)11/h2H,1H3,(H2,8,11)
InChI Key:
BSHRLGFWSDXIJS-UHFFFAOYSA-N
SMILES:
CSc1ncc(c(n1)C(=O)N)Cl
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.992g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.644g/mol
Monoisotopic Mass:
202.992g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties