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Home Sulfos 5-Amino-n-(2-methoxy-phenyl)-2-pyrrolidin-1-yl-benzenesulfonamide

5-Amino-n-(2-methoxy-phenyl)-2-pyrrolidin-1-yl-benzenesulfonamide

CAS No.:
326619-12-9
Catalog Number:
AG00I67G
Molecular Formula:
C17H21N3O3S
Molecular Weight:
347.4319
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Product Description
Catalog Number:
AG00I67G
Chemical Name:
5-Amino-n-(2-methoxy-phenyl)-2-pyrrolidin-1-yl-benzenesulfonamide
CAS Number:
326619-12-9
Molecular Formula:
C17H21N3O3S
Molecular Weight:
347.4319
MDL Number:
MFCD02702400
IUPAC Name:
5-amino-N-(2-methoxyphenyl)-2-pyrrolidin-1-ylbenzenesulfonamide
InChI:
InChI=1S/C17H21N3O3S/c1-23-16-7-3-2-6-14(16)19-24(21,22)17-12-13(18)8-9-15(17)20-10-4-5-11-20/h2-3,6-9,12,19H,4-5,10-11,18H2,1H3
InChI Key:
PSBGOCIZSKXNGC-UHFFFAOYSA-N
SMILES:
COc1ccccc1NS(=O)(=O)c1cc(N)ccc1N1CCCC1
Properties
Complexity:
502  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.13g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
347.433g/mol
Monoisotopic Mass:
347.13g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
93A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
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