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604739-77-7

604739-77-7 | Butanenitrile, 4-[[5-(2-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]- (9CI)

CAS No: 604739-77-7 Catalog No: AG00ER15 MDL No:

Product Description

Catalog Number:
AG00ER15
Chemical Name:
Butanenitrile, 4-[[5-(2-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]- (9CI)
CAS Number:
604739-77-7
IUPAC Name:
4-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]butanenitrile
InChI:
InChI=1S/C11H10N4OS/c12-6-2-4-8-17-11-15-14-10(16-11)9-5-1-3-7-13-9/h1,3,5,7H,2,4,8H2
InChI Key:
FBSZGYKMWNEYLA-UHFFFAOYSA-N

Properties

Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.058g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.288g/mol
Monoisotopic Mass:
246.058g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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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