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55489-15-1 | 5-Ethoxy-1H-benzo[d]imidazole-2-thiol
CAS No: 55489-15-1 Catalog No: AG003MPZ MDL No:MFCD01326487
Product Description
Catalog Number:
AG003MPZ
Chemical Name:
5-Ethoxy-1H-benzo[d]imidazole-2-thiol
CAS Number:
55489-15-1
Molecular Formula:
C9H10N2OS
Molecular Weight:
194.2535
MDL Number:
MFCD01326487
IUPAC Name:
5-ethoxy-1,3-dihydrobenzimidazole-2-thione
InChI:
InChI=1S/C9H10N2OS/c1-2-12-6-3-4-7-8(5-6)11-9(13)10-7/h3-5H,2H2,1H3,(H2,10,11,13)
InChI Key:
WUSCBOFBIYZVCQ-UHFFFAOYSA-N
SMILES:
CCOc1ccc2c(c1)nc([nH]2)S
EC Number:
611-274-1
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
194.252g/mol
Monoisotopic Mass:
194.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Structural motifs and biological studies of new antimony(III) iodide complexes with thiones. | Inorganic chemistry 20100118 |
| New antimony(III) bromide complexes with thioamides: synthesis, characterization, and cytostatic properties. | Inorganic chemistry 20090302 |
| Synthesis, structural characterization, and biological studies of new antimony(III) complexes with thiones. The influence of the solvent on the geometry of the complexes. | Inorganic chemistry 20071015 |
| 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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