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1004527-75-6 | Piperidine, 4-(5-phenyl-1,3,4-oxadiazol-2-yl)-, hydrochloride (1:1)
CAS No: 1004527-75-6 Catalog No: AG00020N MDL No:
Product Description
Catalog Number:
AG00020N
Chemical Name:
Piperidine, 4-(5-phenyl-1,3,4-oxadiazol-2-yl)-, hydrochloride (1:1)
CAS Number:
1004527-75-6
Molecular Formula:
C13H16ClN3O
Molecular Weight:
265.7386
IUPAC Name:
2-phenyl-5-piperidin-4-yl-1,3,4-oxadiazole;hydrochloride
InChI:
InChI=1S/C13H15N3O.ClH/c1-2-4-10(5-3-1)12-15-16-13(17-12)11-6-8-14-9-7-11;/h1-5,11,14H,6-9H2;1H
InChI Key:
QGZRSHKENQEFIN-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1nnc(o1)c1ccccc1.Cl
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.098g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.741g/mol
Monoisotopic Mass:
265.098g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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