Home Other Building Blocks 2-(5-methylthiophen-2-yl)-1H-1,3-benzodiazole

2-(5-methylthiophen-2-yl)-1H-1,3-benzodiazole

CAS No.:
78706-12-4
Catalog Number:
AG01A239
Molecular Formula:
C12H10N2S
Molecular Weight:
214.2862
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Product Description
Catalog Number:
AG01A239
Chemical Name:
2-(5-methylthiophen-2-yl)-1H-1,3-benzodiazole
CAS Number:
78706-12-4
Molecular Formula:
C12H10N2S
Molecular Weight:
214.2862
MDL Number:
MFCD01223796
IUPAC Name:
2-(5-methylthiophen-2-yl)-1H-benzimidazole
InChI:
InChI=1S/C12H10N2S/c1-8-6-7-11(15-8)12-13-9-4-2-3-5-10(9)14-12/h2-7H,1H3,(H,13,14)
InChI Key:
VKEYVDPRFIYFDZ-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)c1nc2c([nH]1)cccc2
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.056g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.286g/mol
Monoisotopic Mass:
214.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
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
Properties