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1233958-23-0 | 3-Bromo-N-(piperidin-4-yl)benzenesulfonamide hydrochloride
CAS No: 1233958-23-0 Catalog No: AG01F70P MDL No:
Product Description
Catalog Number:
AG01F70P
Chemical Name:
3-Bromo-N-(piperidin-4-yl)benzenesulfonamide hydrochloride
CAS Number:
1233958-23-0
Molecular Formula:
C11H16BrClN2O2S
Molecular Weight:
355.6789
IUPAC Name:
3-bromo-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
InChI:
InChI=1S/C11H15BrN2O2S.ClH/c12-9-2-1-3-11(8-9)17(15,16)14-10-4-6-13-7-5-10;/h1-3,8,10,13-14H,4-7H2;1H
InChI Key:
MDILHDIEBWBFHI-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)S(=O)(=O)NC1CCNCC1.Cl
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.98g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
355.675g/mol
Monoisotopic Mass:
353.98g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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