Home Other Building Blocks imino(methyl)(pyrimidin-2-yl)-lambda6-sulfanone

imino(methyl)(pyrimidin-2-yl)-lambda6-sulfanone

CAS No.:
2060044-55-3
Catalog Number:
AG01BVCE
Molecular Formula:
C5H7N3OS
Molecular Weight:
157.1936
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Product Description
Catalog Number:
AG01BVCE
Chemical Name:
imino(methyl)(pyrimidin-2-yl)-lambda6-sulfanone
CAS Number:
2060044-55-3
Molecular Formula:
C5H7N3OS
Molecular Weight:
157.1936
MDL Number:
MFCD30345453
IUPAC Name:
imino-methyl-oxo-pyrimidin-2-yl-λ6-sulfane
InChI:
InChI=1S/C5H7N3OS/c1-10(6,9)5-7-3-2-4-8-5/h2-4,6H,1H3
InChI Key:
FSGRWNRLVOMTOT-UHFFFAOYSA-N
SMILES:
CS(=O)(=N)c1ncccn1
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.031g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
157.191g/mol
Monoisotopic Mass:
157.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties