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Home Sulfos N-Phenylsulfonyl-L-proline

N-Phenylsulfonyl-L-proline

CAS No.:
88425-47-2
Catalog Number:
AG00H0LF
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
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Product Description
Catalog Number:
AG00H0LF
Chemical Name:
N-Phenylsulfonyl-L-proline
CAS Number:
88425-47-2
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
MDL Number:
MFCD00579687
IUPAC Name:
1-(benzenesulfonyl)pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C11H13NO4S/c13-11(14)10-7-4-8-12(10)17(15,16)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,13,14)
InChI Key:
JUSWZYFYLXTMLJ-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCN1S(=O)(=O)c1ccccc1
Properties
Complexity:
381  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.057g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.288g/mol
Monoisotopic Mass:
255.057g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
4,7-Dichloro benzothien-2-yl sulfonylaminomethyl boronic acid: first boronic acid-derived beta-lactamase inhibitor with class A, C, and D activity. Bioorganic & medicinal chemistry letters 20100415
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