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Home > Pyridines > 1239503-32-2
1239503-32-2 | N-(4-carbamothioylpyridin-2-yl)acetamide
CAS No: 1239503-32-2 Catalog No: AG01B9HV MDL No:MFCD20726787
Product Description
Catalog Number:
AG01B9HV
Chemical Name:
N-(4-carbamothioylpyridin-2-yl)acetamide
CAS Number:
1239503-32-2
Molecular Formula:
C8H9N3OS
Molecular Weight:
195.2416
MDL Number:
MFCD20726787
IUPAC Name:
N-(4-carbamothioylpyridin-2-yl)acetamide
InChI:
InChI=1S/C8H9N3OS/c1-5(12)11-7-4-6(8(9)13)2-3-10-7/h2-4H,1H3,(H2,9,13)(H,10,11,12)
InChI Key:
QSFYCCPMHTWGJZ-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1nccc(c1)C(=S)N
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.047g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.24g/mol
Monoisotopic Mass:
195.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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