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Home > Imidazoles > 436089-85-9
436089-85-9 | 5-[2-(1H-BENZOIMIDAZOL-2-YL)-ETHYL]-4-METHYL-4H-[1,2,4]TRIAZOLE-3-THIOL
CAS No: 436089-85-9 Catalog No: AG00DWK8 MDL No:MFCD02590974
Product Description
Catalog Number:
AG00DWK8
Chemical Name:
5-[2-(1H-BENZOIMIDAZOL-2-YL)-ETHYL]-4-METHYL-4H-[1,2,4]TRIAZOLE-3-THIOL
CAS Number:
436089-85-9
MDL Number:
MFCD02590974
IUPAC Name:
3-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
InChI:
InChI=1S/C12H13N5S/c1-17-11(15-16-12(17)18)7-6-10-13-8-4-2-3-5-9(8)14-10/h2-5H,6-7H2,1H3,(H,13,14)(H,16,18)
InChI Key:
MKSYBYONNBYASX-UHFFFAOYSA-N
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.089g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
259.331g/mol
Monoisotopic Mass:
259.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
88.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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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