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209350-34-5 | Benzenesulfonamide, N-methyl-N-(2-methyl-4-oxo-2-phenylbutyl)-
CAS No: 209350-34-5 Catalog No: AG002K6L MDL No:
Product Description
Catalog Number:
AG002K6L
Chemical Name:
Benzenesulfonamide, N-methyl-N-(2-methyl-4-oxo-2-phenylbutyl)-
CAS Number:
209350-34-5
Molecular Formula:
C18H21NO3S
Molecular Weight:
331.4292
IUPAC Name:
N-methyl-N-(2-methyl-4-oxo-2-phenylbutyl)benzenesulfonamide
InChI:
InChI=1S/C18H21NO3S/c1-18(13-14-20,16-9-5-3-6-10-16)15-19(2)23(21,22)17-11-7-4-8-12-17/h3-12,14H,13,15H2,1-2H3
InChI Key:
XIYCLVWSUDYQDH-UHFFFAOYSA-N
SMILES:
O=CCC(c1ccccc1)(CN(S(=O)(=O)c1ccccc1)C)C
Properties
Complexity:
473
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.124g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.43g/mol
Monoisotopic Mass:
331.124g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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