Home Aminos 4(3H)-Pyrimidinone,6-amino-2-(methylthio)-5-nitroso-

4(3H)-Pyrimidinone,6-amino-2-(methylthio)-5-nitroso-

CAS No.:
43005-49-8
Catalog Number:
AG00707I
Molecular Formula:
C5H6N4O2S
Molecular Weight:
186.1917
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Product Description
Catalog Number:
AG00707I
Chemical Name:
4(3H)-Pyrimidinone,6-amino-2-(methylthio)-5-nitroso-
CAS Number:
43005-49-8
Molecular Formula:
C5H6N4O2S
Molecular Weight:
186.1917
MDL Number:
MFCD02091180
IUPAC Name:
4-amino-2-methylsulfanyl-5-nitroso-1H-pyrimidin-6-one
InChI:
InChI=1S/C5H6N4O2S/c1-12-5-7-3(6)2(9-11)4(10)8-5/h1H3,(H3,6,7,8,10)
InChI Key:
XKAYRHLZQHITSP-UHFFFAOYSA-N
SMILES:
CSc1nc(N)c(c(=O)[nH]1)N=O
NSC Number:
9304
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.021g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.189g/mol
Monoisotopic Mass:
186.021g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties