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2060030-45-5

2060030-45-5 | 2-[5-(3-methylazetidin-3-yl)-1,3,4-oxadiazol-2-yl]pyridine dihydrochloride

CAS No: 2060030-45-5 Catalog No: AG01BR1L MDL No:MFCD30502180

Product Description

Catalog Number:
AG01BR1L
Chemical Name:
2-[5-(3-methylazetidin-3-yl)-1,3,4-oxadiazol-2-yl]pyridine dihydrochloride
CAS Number:
2060030-45-5
Molecular Formula:
C11H14Cl2N4O
Molecular Weight:
289.1611
MDL Number:
MFCD30502180
IUPAC Name:
2-(3-methylazetidin-3-yl)-5-pyridin-2-yl-1,3,4-oxadiazole;dihydrochloride
InChI:
InChI=1S/C11H12N4O.2ClH/c1-11(6-12-7-11)10-15-14-9(16-10)8-4-2-3-5-13-8;;/h2-5,12H,6-7H2,1H3;2*1H
InChI Key:
OXDKUBDIWDLVNR-UHFFFAOYSA-N
SMILES:
CC1(CNC1)c1nnc(o1)c1ccccn1.Cl.Cl

Properties

Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.054g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
289.16g/mol
Monoisotopic Mass:
288.054g/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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