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88264-12-4

88264-12-4 | 1H-Imidazole, 2-(cyclohexylthio)-4,5-bis(4-methoxyphenyl)-

CAS No: 88264-12-4 Catalog No: AG008AVC MDL No:

Product Description

Catalog Number:
AG008AVC
Chemical Name:
1H-Imidazole, 2-(cyclohexylthio)-4,5-bis(4-methoxyphenyl)-
CAS Number:
88264-12-4
Molecular Formula:
C23H26N2O2S
Molecular Weight:
394.5297
IUPAC Name:
2-cyclohexylsulfanyl-4,5-bis(4-methoxyphenyl)-1H-imidazole
InChI:
InChI=1S/C23H26N2O2S/c1-26-18-12-8-16(9-13-18)21-22(17-10-14-19(27-2)15-11-17)25-23(24-21)28-20-6-4-3-5-7-20/h8-15,20H,3-7H2,1-2H3,(H,24,25)
InChI Key:
AQPIERAELQVNTA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)OC)SC1CCCCC1

Properties

Complexity:
458  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
394.171g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
394.533g/mol
Monoisotopic Mass:
394.171g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
72.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6  

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