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Home > Pyridines > 852400-11-4
852400-11-4 | 5-(PIPERIDIN-1-YLSULFONYL)PYRIDINE-2-THIOL
CAS No: 852400-11-4 Catalog No: AG00G3U7 MDL No:MFCD06655491
Product Description
Catalog Number:
AG00G3U7
Chemical Name:
5-(PIPERIDIN-1-YLSULFONYL)PYRIDINE-2-THIOL
CAS Number:
852400-11-4
Molecular Formula:
C10H14N2O2S2
Molecular Weight:
258.3604
MDL Number:
MFCD06655491
IUPAC Name:
5-piperidin-1-ylsulfonyl-1H-pyridine-2-thione
InChI:
InChI=1S/C10H14N2O2S2/c13-16(14,12-6-2-1-3-7-12)9-4-5-10(15)11-8-9/h4-5,8H,1-3,6-7H2,(H,11,15)
InChI Key:
MNXQWRWGIOERRI-UHFFFAOYSA-N
SMILES:
Sc1ccc(cn1)S(=O)(=O)N1CCCCC1
Properties
Complexity:
440
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.05g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.354g/mol
Monoisotopic Mass:
258.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
89.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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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