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Home > Pyridines > 1692590-10-5
1692590-10-5 | {5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-yl}methanesulfonamide
CAS No: 1692590-10-5 Catalog No: AG01B3T5 MDL No:
Product Description
Catalog Number:
AG01B3T5
Chemical Name:
{5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-yl}methanesulfonamide
CAS Number:
1692590-10-5
Molecular Formula:
C7H12N4O2S
Molecular Weight:
216.2608
IUPAC Name:
5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethanesulfonamide
InChI:
InChI=1S/C7H12N4O2S/c8-14(12,13)5-7-10-9-6-3-1-2-4-11(6)7/h1-5H2,(H2,8,12,13)
InChI Key:
OHTAEIGGKHKKEX-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)Cc1nnc2n1CCCC2
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.068g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.259g/mol
Monoisotopic Mass:
216.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
99.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
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