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26209-27-8 | 1-(2,4-dimethylphenyl)-1H-imidazole-2-thiol
CAS No: 26209-27-8 Catalog No: AG019IA5 MDL No:MFCD04621557
Product Description
Catalog Number:
AG019IA5
Chemical Name:
1-(2,4-dimethylphenyl)-1H-imidazole-2-thiol
CAS Number:
26209-27-8
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
MDL Number:
MFCD04621557
IUPAC Name:
3-(2,4-dimethylphenyl)-1H-imidazole-2-thione
InChI:
InChI=1S/C11H12N2S/c1-8-3-4-10(9(2)7-8)13-6-5-12-11(13)14/h3-7H,1-2H3,(H,12,14)
InChI Key:
NRDBUFOGZXXCRC-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C)n1ccnc1S
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.291g/mol
Monoisotopic Mass:
204.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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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