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1052543-23-3

1052543-23-3 | 4-(piperazine-1-sulfonyl)benzene-1-sulfonamide hydrochloride

CAS No: 1052543-23-3 Catalog No: AG019OTJ MDL No:MFCD07685850

Product Description

Catalog Number:
AG019OTJ
Chemical Name:
4-(piperazine-1-sulfonyl)benzene-1-sulfonamide hydrochloride
CAS Number:
1052543-23-3
Molecular Formula:
C10H16ClN3O4S2
Molecular Weight:
341.8347
MDL Number:
MFCD07685850
IUPAC Name:
4-piperazin-1-ylsulfonylbenzenesulfonamide;hydrochloride
InChI:
InChI=1S/C10H15N3O4S2.ClH/c11-18(14,15)9-1-3-10(4-2-9)19(16,17)13-7-5-12-6-8-13;/h1-4,12H,5-8H2,(H2,11,14,15);1H
InChI Key:
YEWDDFPMSJKHCU-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccc(cc1)S(=O)(=O)N)N1CCNCC1.Cl

Properties

Complexity:
492  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.027g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
341.825g/mol
Monoisotopic Mass:
341.027g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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