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Home > Imidazoles > 793678-92-9
793678-92-9 | 1-(4-ethoxyphenyl)-5-phenyl-1H-imidazole-2-thiol
CAS No: 793678-92-9 Catalog No: AG019NNJ MDL No:MFCD06363466
Product Description
Catalog Number:
AG019NNJ
Chemical Name:
1-(4-ethoxyphenyl)-5-phenyl-1H-imidazole-2-thiol
CAS Number:
793678-92-9
Molecular Formula:
C17H16N2OS
Molecular Weight:
296.3867
MDL Number:
MFCD06363466
IUPAC Name:
3-(4-ethoxyphenyl)-4-phenyl-1H-imidazole-2-thione
InChI:
InChI=1S/C17H16N2OS/c1-2-20-15-10-8-14(9-11-15)19-16(12-18-17(19)21)13-6-4-3-5-7-13/h3-12H,2H2,1H3,(H,18,21)
InChI Key:
DZEXPJCQBLAYOC-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)n1c(S)ncc1c1ccccc1
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.098g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.388g/mol
Monoisotopic Mass:
296.098g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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