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Home > Pyridines > 1248948-02-8
1248948-02-8 | 3-{[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl}piperidine
CAS No: 1248948-02-8 Catalog No: AG01ACKH MDL No:MFCD16839428
Product Description
Catalog Number:
AG01ACKH
Chemical Name:
3-{[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl}piperidine
CAS Number:
1248948-02-8
Molecular Formula:
C12H16N4
Molecular Weight:
216.2822
MDL Number:
MFCD16839428
IUPAC Name:
3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridine
InChI:
InChI=1S/C12H16N4/c1-2-7-16-11(5-1)14-15-12(16)8-10-4-3-6-13-9-10/h1-2,5,7,10,13H,3-4,6,8-9H2
InChI Key:
SFVJAVLMNPHPFP-UHFFFAOYSA-N
SMILES:
C1CCC(CN1)Cc1nnc2n1cccc2
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.288g/mol
Monoisotopic Mass:
216.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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