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140405-69-2

140405-69-2 | Thiazolo[3,2-b][1,2,4]triazole, 6-phenyl-2-(3,4,5-trimethoxyphenyl)-

CAS No: 140405-69-2 Catalog No: AG001CCK MDL No:

Product Description

Catalog Number:
AG001CCK
Chemical Name:
Thiazolo[3,2-b][1,2,4]triazole, 6-phenyl-2-(3,4,5-trimethoxyphenyl)-
CAS Number:
140405-69-2
Molecular Formula:
C19H17N3O3S
Molecular Weight:
367.4216
IUPAC Name:
6-phenyl-2-(3,4,5-trimethoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole
InChI:
InChI=1S/C19H17N3O3S/c1-23-15-9-13(10-16(24-2)17(15)25-3)18-20-19-22(21-18)14(11-26-19)12-7-5-4-6-8-12/h4-11H,1-3H3
InChI Key:
ZEIAIVNOMZESEN-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1OC)OC)c1nn2c(n1)scc2c1ccccc1

Properties

Complexity:
451  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.099g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
367.423g/mol
Monoisotopic Mass:
367.099g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
86.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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