200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 81527-04-0
81527-04-0 | 1H-Imidazole, 4,5-bis(4-methoxyphenyl)-2-(2-thienylthio)-
CAS No: 81527-04-0 Catalog No: AG005K7Q MDL No:
Product Description
Catalog Number:
AG005K7Q
Chemical Name:
1H-Imidazole, 4,5-bis(4-methoxyphenyl)-2-(2-thienylthio)-
CAS Number:
81527-04-0
Molecular Formula:
C21H18N2O2S2
Molecular Weight:
394.5098
IUPAC Name:
4,5-bis(4-methoxyphenyl)-2-thiophen-2-ylsulfanyl-1H-imidazole
InChI:
InChI=1S/C21H18N2O2S2/c1-24-16-9-5-14(6-10-16)19-20(15-7-11-17(25-2)12-8-15)23-21(22-19)27-18-4-3-13-26-18/h3-13H,1-2H3,(H,22,23)
InChI Key:
PMSRSEWSFQOTNC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)OC)Sc1cccs1
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
394.081g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
394.507g/mol
Monoisotopic Mass:
394.081g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.