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1004-65-5 | 1,2,4-Triazolo[4,3-a]pyridine, 3-methyl-
CAS No: 1004-65-5 Catalog No: AG0001WR MDL No:MFCD00498952
Product Description
Catalog Number:
AG0001WR
Chemical Name:
1,2,4-Triazolo[4,3-a]pyridine, 3-methyl-
CAS Number:
1004-65-5
Molecular Formula:
C7H7N3
Molecular Weight:
133.1506
MDL Number:
MFCD00498952
IUPAC Name:
3-methyl-[1,2,4]triazolo[4,3-a]pyridine
InChI:
InChI=1S/C7H7N3/c1-6-8-9-7-4-2-3-5-10(6)7/h2-5H,1H3
InChI Key:
XKXVBWLYSGMTCK-UHFFFAOYSA-N
SMILES:
Cc1nnc2n1cccc2
NSC Number:
68458
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.064g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
133.154g/mol
Monoisotopic Mass:
133.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Theoretical and experimental design of atypical kinase inhibitors: application to p38 MAP kinase. | Journal of medicinal chemistry 20050908 |
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