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Home > Pyridines > 732978-38-0
732978-38-0 | 4-[5-(piperidin-4-yl)-1,3,4-oxadiazol-2-yl]pyridine
CAS No: 732978-38-0 Catalog No: AG00FBB5 MDL No:MFCD11610664
Product Description
Catalog Number:
AG00FBB5
Chemical Name:
4-[5-(piperidin-4-yl)-1,3,4-oxadiazol-2-yl]pyridine
CAS Number:
732978-38-0
Molecular Formula:
C12H14N4O
Molecular Weight:
230.2658
MDL Number:
MFCD11610664
IUPAC Name:
2-piperidin-4-yl-5-pyridin-4-yl-1,3,4-oxadiazole
InChI:
InChI=1S/C12H14N4O/c1-5-13-6-2-9(1)11-15-16-12(17-11)10-3-7-14-8-4-10/h1-2,5-6,10,14H,3-4,7-8H2
InChI Key:
YHLMXXMMZLBIMG-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1nnc(o1)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:
0.5
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