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Home > Pyridines > 1965304-89-5
1965304-89-5 | 1,3-Bis[(3-(3-methyl-2-pyridin-2-yl)-1,2,4-oxadiazol)-5-yl]benzene
CAS No: 1965304-89-5 Catalog No: AG01EUGN MDL No:MFCD28166195
Product Description
Catalog Number:
AG01EUGN
Chemical Name:
1,3-Bis[(3-(3-methyl-2-pyridin-2-yl)-1,2,4-oxadiazol)-5-yl]benzene
CAS Number:
1965304-89-5
Molecular Formula:
C22H16N6O2
Molecular Weight:
396.4014
MDL Number:
MFCD28166195
IUPAC Name:
3-(3-methylpyridin-2-yl)-5-[3-[3-(3-methylpyridin-2-yl)-1,2,4-oxadiazol-5-yl]phenyl]-1,2,4-oxadiazole
InChI:
InChI=1S/C22H16N6O2/c1-13-6-4-10-23-17(13)19-25-21(29-27-19)15-8-3-9-16(12-15)22-26-20(28-30-22)18-14(2)7-5-11-24-18/h3-12H,1-2H3
InChI Key:
HGQUVKUXAVMIFB-UHFFFAOYSA-N
SMILES:
Cc1cccnc1c1noc(n1)c1cccc(c1)c1onc(n1)c1ncccc1C
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.133g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.41g/mol
Monoisotopic Mass:
396.133g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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