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Home > Pyridines > 1638612-90-4
1638612-90-4 | 3-[5-(piperidin-4-yl)-1,2,4-oxadiazol-3-yl]pyridine dihydrochloride
CAS No: 1638612-90-4 Catalog No: AG00J0PZ MDL No:MFCD28155232
Product Description
Catalog Number:
AG00J0PZ
Chemical Name:
3-[5-(piperidin-4-yl)-1,2,4-oxadiazol-3-yl]pyridine dihydrochloride
CAS Number:
1638612-90-4
Molecular Formula:
C12H16Cl2N4O
Molecular Weight:
303.1876
MDL Number:
MFCD28155232
IUPAC Name:
5-piperidin-4-yl-3-pyridin-3-yl-1,2,4-oxadiazole;dihydrochloride
InChI:
InChI=1S/C12H14N4O.2ClH/c1-2-10(8-14-5-1)11-15-12(17-16-11)9-3-6-13-7-4-9;;/h1-2,5,8-9,13H,3-4,6-7H2;2*1H
InChI Key:
DOGNAMNSRKUQHH-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1onc(n1)c1cccnc1.Cl.Cl
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.07g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
303.187g/mol
Monoisotopic Mass:
302.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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