Home Sulfos 1-[(2,5-dimethoxyphenyl)sulfonyl]piperazine

1-[(2,5-dimethoxyphenyl)sulfonyl]piperazine

CAS No.:
524711-13-5
Catalog Number:
AG00JBST
Molecular Formula:
C12H18N2O4S
Molecular Weight:
286.3473
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Product Description
Catalog Number:
AG00JBST
Chemical Name:
1-[(2,5-dimethoxyphenyl)sulfonyl]piperazine
CAS Number:
524711-13-5
Molecular Formula:
C12H18N2O4S
Molecular Weight:
286.3473
MDL Number:
MFCD03444517
IUPAC Name:
1-(2,5-dimethoxyphenyl)sulfonylpiperazine
InChI:
InChI=1S/C12H18N2O4S/c1-17-10-3-4-11(18-2)12(9-10)19(15,16)14-7-5-13-6-8-14/h3-4,9,13H,5-8H2,1-2H3
InChI Key:
CTLQZVODPMGFBU-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1S(=O)(=O)N1CCNCC1)OC
Properties
Complexity:
376  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.099g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
286.346g/mol
Monoisotopic Mass:
286.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
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