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Home > Pyridines > 276237-03-7
276237-03-7 | Pyridine, 4-[5-(4-piperidinyl)-1,2,4-oxadiazol-3-yl]-
CAS No: 276237-03-7 Catalog No: AG002U9Q MDL No:
Product Description
Catalog Number:
AG002U9Q
Chemical Name:
Pyridine, 4-[5-(4-piperidinyl)-1,2,4-oxadiazol-3-yl]-
CAS Number:
276237-03-7
Molecular Formula:
C12H14N4O
Molecular Weight:
230.2658
IUPAC Name:
5-piperidin-4-yl-3-pyridin-4-yl-1,2,4-oxadiazole
InChI:
InChI=1S/C12H14N4O/c1-5-13-6-2-9(1)11-15-12(17-16-11)10-3-7-14-8-4-10/h1-2,5-6,10,14H,3-4,7-8H2
InChI Key:
OAAGDVLVOKMRCQ-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1onc(n1)c1ccncc1
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.117g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.271g/mol
Monoisotopic Mass:
230.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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