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84000-66-8

84000-66-8 | 6-[(5-cyanoisothiazolo[3,4-b]pyridin-3-yl)azo]-3,4-dihydro-2,2,4,7-tetramethyl-2H-quinoline-1-propiononitrile

CAS No: 84000-66-8 Catalog No: AG00GNQS MDL No:

Product Description

Catalog Number:
AG00GNQS
Chemical Name:
6-[(5-cyanoisothiazolo[3,4-b]pyridin-3-yl)azo]-3,4-dihydro-2,2,4,7-tetramethyl-2H-quinoline-1-propiononitrile
CAS Number:
84000-66-8
IUPAC Name:
3-[[1-(2-cyanoethyl)-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl]diazenyl]-[1,2]thiazolo[3,4-b]pyridine-5-carbonitrile
InChI:
InChI=1S/C23H23N7S/c1-14-8-20-17(15(2)11-23(3,4)30(20)7-5-6-24)10-19(14)27-28-22-18-9-16(12-25)13-26-21(18)29-31-22/h8-10,13,15H,5,7,11H2,1-4H3
InChI Key:
XNSSERKYNNFROD-UHFFFAOYSA-N
EC Number:
281-622-1

Properties

Complexity:
779  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
429.174g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
429.546g/mol
Monoisotopic Mass:
429.174g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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