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Home > Imidazoles > 26495-07-8
26495-07-8 | 2H-Benzimidazole-2-thione, 1,3-dihydro-1-(4-methoxyphenyl)-
CAS No: 26495-07-8 Catalog No: AG002TGH MDL No:MFCD03476785
Product Description
Catalog Number:
AG002TGH
Chemical Name:
2H-Benzimidazole-2-thione, 1,3-dihydro-1-(4-methoxyphenyl)-
CAS Number:
26495-07-8
Molecular Formula:
C14H12N2OS
Molecular Weight:
256.3229
MDL Number:
MFCD03476785
IUPAC Name:
3-(4-methoxyphenyl)-1H-benzimidazole-2-thione
InChI:
InChI=1S/C14H12N2OS/c1-17-11-8-6-10(7-9-11)16-13-5-3-2-4-12(13)15-14(16)18/h2-9H,1H3,(H,15,18)
InChI Key:
WMEZOZSFUBAVPB-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)n1c(=S)[nH]c2c1cccc2
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.067g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.323g/mol
Monoisotopic Mass:
256.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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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