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Home > Pyridines > 2060041-15-6
2060041-15-6 | 3-[5-(3-methylazetidin-3-yl)-1,3,4-oxadiazol-2-yl]pyridine trihydrochloride
CAS No: 2060041-15-6 Catalog No: AG01C0DV MDL No:MFCD30497955
Product Description
Catalog Number:
AG01C0DV
Chemical Name:
3-[5-(3-methylazetidin-3-yl)-1,3,4-oxadiazol-2-yl]pyridine trihydrochloride
CAS Number:
2060041-15-6
Molecular Formula:
C11H15Cl3N4O
Molecular Weight:
325.6220
MDL Number:
MFCD30497955
IUPAC Name:
2-(3-methylazetidin-3-yl)-5-pyridin-3-yl-1,3,4-oxadiazole;trihydrochloride
InChI:
InChI=1S/C11H12N4O.3ClH/c1-11(6-13-7-11)10-15-14-9(16-10)8-3-2-4-12-5-8;;;/h2-5,13H,6-7H2,1H3;3*1H
InChI Key:
YMONJSPXZVPYHU-UHFFFAOYSA-N
SMILES:
CC1(CNC1)c1nnc(o1)c1cccnc1.Cl.Cl.Cl
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.031g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
325.618g/mol
Monoisotopic Mass:
324.031g/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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