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189364-26-9

189364-26-9 | 2H-Imidazole-2-thione, 4,5-bis(3,4-dimethoxyphenyl)-1,3-dihydro-

CAS No: 189364-26-9 Catalog No: AG002DLI MDL No:

Product Description

Catalog Number:
AG002DLI
Chemical Name:
2H-Imidazole-2-thione, 4,5-bis(3,4-dimethoxyphenyl)-1,3-dihydro-
CAS Number:
189364-26-9
Molecular Formula:
C19H20N2O4S
Molecular Weight:
372.4381
IUPAC Name:
4,5-bis(3,4-dimethoxyphenyl)-1,3-dihydroimidazole-2-thione
InChI:
InChI=1S/C19H20N2O4S/c1-22-13-7-5-11(9-15(13)24-3)17-18(21-19(26)20-17)12-6-8-14(23-2)16(10-12)25-4/h5-10H,1-4H3,(H2,20,21,26)
InChI Key:
PQRCNVBTAIDPBU-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)c1[nH]c(=S)[nH]c1c1ccc(c(c1)OC)OC

Properties

Complexity:
498  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.114g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
372.439g/mol
Monoisotopic Mass:
372.114g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
93.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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