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374606-03-8 | N-(2-Acetyl-4,5-dimethoxy-phenyl)-4-methyl-benzenesulfonamide
CAS No: 374606-03-8 Catalog No: AG01F6K5 MDL No:
Product Description
Catalog Number:
AG01F6K5
Chemical Name:
N-(2-Acetyl-4,5-dimethoxy-phenyl)-4-methyl-benzenesulfonamide
CAS Number:
374606-03-8
Molecular Formula:
C17H19NO5S
Molecular Weight:
349.4015
IUPAC Name:
N-(2-acetyl-4,5-dimethoxyphenyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C17H19NO5S/c1-11-5-7-13(8-6-11)24(20,21)18-15-10-17(23-4)16(22-3)9-14(15)12(2)19/h5-10,18H,1-4H3
InChI Key:
QMSAEIAHEXWOHB-UHFFFAOYSA-N
SMILES:
COc1cc(NS(=O)(=O)c2ccc(cc2)C)c(cc1OC)C(=O)C
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.098g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
349.401g/mol
Monoisotopic Mass:
349.098g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
90.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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