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923030-43-7

923030-43-7 | Benzothiazole, 2-[(1Z)-2-(2,4-dimethoxyphenyl)ethenyl]-

CAS No: 923030-43-7 Catalog No: AG006L27 MDL No:

Product Description

Catalog Number:
AG006L27
Chemical Name:
Benzothiazole, 2-[(1Z)-2-(2,4-dimethoxyphenyl)ethenyl]-
CAS Number:
923030-43-7
Molecular Formula:
C17H15NO2S
Molecular Weight:
297.3715
IUPAC Name:
2-[2-(2,4-dimethoxyphenyl)ethenyl]-1,3-benzothiazole
InChI:
InChI=1S/C17H15NO2S/c1-19-13-9-7-12(15(11-13)20-2)8-10-17-18-14-5-3-4-6-16(14)21-17/h3-11H,1-2H3
InChI Key:
IYPRQXFPCMCBFG-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OC)/C=C\c1nc2c(s1)cccc2

Properties

Complexity:
363  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.082g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.372g/mol
Monoisotopic Mass:
297.082g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
4.6  

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