Home Sulfos 5-(morpholine-4-sulfonyl)pyridine-2-thiol

5-(morpholine-4-sulfonyl)pyridine-2-thiol

CAS No.:
852706-13-9
Catalog Number:
AG019O6J
Molecular Formula:
C9H12N2O3S2
Molecular Weight:
260.3332
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Product Description
Catalog Number:
AG019O6J
Chemical Name:
5-(morpholine-4-sulfonyl)pyridine-2-thiol
CAS Number:
852706-13-9
Molecular Formula:
C9H12N2O3S2
Molecular Weight:
260.3332
MDL Number:
MFCD06655568
IUPAC Name:
5-morpholin-4-ylsulfonyl-1H-pyridine-2-thione
InChI:
InChI=1S/C9H12N2O3S2/c12-16(13,11-3-5-14-6-4-11)8-1-2-9(15)10-7-8/h1-2,7H,3-6H2,(H,10,15)
InChI Key:
VCNXVLIMLQVVFT-UHFFFAOYSA-N
SMILES:
Sc1ccc(cn1)S(=O)(=O)N1CCOCC1
Properties
Complexity:
442  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.029g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
260.326g/mol
Monoisotopic Mass:
260.029g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
99.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
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