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1240529-27-4 | 4-methyl-N-(piperidin-3-ylmethyl)benzene-1-sulfonamide hydrochloride
CAS No: 1240529-27-4 Catalog No: AG01A94W MDL No:MFCD16547645
Product Description
Catalog Number:
AG01A94W
Chemical Name:
4-methyl-N-(piperidin-3-ylmethyl)benzene-1-sulfonamide hydrochloride
CAS Number:
1240529-27-4
Molecular Formula:
C13H21ClN2O2S
Molecular Weight:
304.8360
MDL Number:
MFCD16547645
IUPAC Name:
4-methyl-N-(piperidin-3-ylmethyl)benzenesulfonamide;hydrochloride
InChI:
InChI=1S/C13H20N2O2S.ClH/c1-11-4-6-13(7-5-11)18(16,17)15-10-12-3-2-8-14-9-12;/h4-7,12,14-15H,2-3,8-10H2,1H3;1H
InChI Key:
ALFSMDMFRCRDRR-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)NCC1CCCNC1.Cl
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.101g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
304.833g/mol
Monoisotopic Mass:
304.101g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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