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Home > Pyridines > 1291487-11-0
1291487-11-0 | 3-methyl-N-(3-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
CAS No: 1291487-11-0 Catalog No: AG00HRX5 MDL No:MFCD18804102
Product Description
Catalog Number:
AG00HRX5
Chemical Name:
3-methyl-N-(3-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
CAS Number:
1291487-11-0
Molecular Formula:
C14H14N4O2S
Molecular Weight:
302.3516
MDL Number:
MFCD18804102
IUPAC Name:
3-methyl-N-(3-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine-8-sulfonamide
InChI:
InChI=1S/C14H14N4O2S/c1-10-5-3-6-12(9-10)17-21(19,20)13-7-4-8-18-11(2)15-16-14(13)18/h3-9,17H,1-2H3
InChI Key:
XWHJQBBVGTVLDK-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)NS(=O)(=O)c1cccn2c1nnc2C
Properties
Complexity:
464
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.084g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
302.352g/mol
Monoisotopic Mass:
302.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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