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Home > Pyridines > 852840-57-4
852840-57-4 | N-Cyclohexyl-6-mercapto-n-methylpyridine-3-sulfonamide
CAS No: 852840-57-4 Catalog No: AG00IDMB MDL No:MFCD06655606
Product Description
Catalog Number:
AG00IDMB
Chemical Name:
N-Cyclohexyl-6-mercapto-n-methylpyridine-3-sulfonamide
CAS Number:
852840-57-4
Molecular Formula:
C12H18N2O2S2
Molecular Weight:
286.4135
MDL Number:
MFCD06655606
IUPAC Name:
N-cyclohexyl-N-methyl-6-sulfanylidene-1H-pyridine-3-sulfonamide
InChI:
InChI=1S/C12H18N2O2S2/c1-14(10-5-3-2-4-6-10)18(15,16)11-7-8-12(17)13-9-11/h7-10H,2-6H2,1H3,(H,13,17)
InChI Key:
JRKBHWGLTCWZBI-UHFFFAOYSA-N
SMILES:
Sc1ccc(cn1)S(=O)(=O)N(C1CCCCC1)C
Properties
Complexity:
483
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.081g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.408g/mol
Monoisotopic Mass:
286.081g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
89.9A^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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