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145731-84-6

145731-84-6 | Pyridine, 3-[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]-

CAS No: 145731-84-6 Catalog No: AG001DC8 MDL No:

Product Description

Catalog Number:
AG001DC8
Chemical Name:
Pyridine, 3-[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]-
CAS Number:
145731-84-6
Molecular Formula:
C13H8BrN3O
Molecular Weight:
302.1261
IUPAC Name:
2-(2-bromophenyl)-5-pyridin-3-yl-1,3,4-oxadiazole
InChI:
InChI=1S/C13H8BrN3O/c14-11-6-2-1-5-10(11)13-17-16-12(18-13)9-4-3-7-15-8-9/h1-8H
InChI Key:
CCPYCXAUSQZJHG-UHFFFAOYSA-N
SMILES:
Brc1ccccc1c1nnc(o1)c1cccnc1

Properties

Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.985g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.131g/mol
Monoisotopic Mass:
300.985g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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