200,000+ products from a single source!
sales@angenechem.com
112544-55-5 | 2(3H)-Thiazolethione, 4,4'-[1,1'-biphenyl]-4,4'-diylbis[3-methyl-
CAS No: 112544-55-5 Catalog No: AG0082CZ MDL No:
Product Description
Catalog Number:
AG0082CZ
Chemical Name:
2(3H)-Thiazolethione, 4,4'-[1,1'-biphenyl]-4,4'-diylbis[3-methyl-
CAS Number:
112544-55-5
Molecular Formula:
C20H16N2S4
Molecular Weight:
412.6144
IUPAC Name:
3-methyl-4-[4-[4-(3-methyl-2-sulfanylidene-1,3-thiazol-4-yl)phenyl]phenyl]-1,3-thiazole-2-thione
InChI:
InChI=1S/C20H16N2S4/c1-21-17(11-25-19(21)23)15-7-3-13(4-8-15)14-5-9-16(10-6-14)18-12-26-20(24)22(18)2/h3-12H,1-2H3
InChI Key:
PYZAIWULCJWTJR-UHFFFAOYSA-N
SMILES:
S=c1scc(n1C)c1ccc(cc1)c1ccc(cc1)c1csc(=S)n1C
Properties
Complexity:
584
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
412.02g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
412.602g/mol
Monoisotopic Mass:
412.02g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.