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736187-46-5 | N-(3,4-Dimethoxyphenyl)-2,5-dimethylbenzenesulfonamide
CAS No: 736187-46-5 Catalog No: AG00ICF6 MDL No:
Product Description
Catalog Number:
AG00ICF6
Chemical Name:
N-(3,4-Dimethoxyphenyl)-2,5-dimethylbenzenesulfonamide
CAS Number:
736187-46-5
Molecular Formula:
C16H19NO4S
Molecular Weight:
321.3914
IUPAC Name:
N-(3,4-dimethoxyphenyl)-2,5-dimethylbenzenesulfonamide
InChI:
InChI=1S/C16H19NO4S/c1-11-5-6-12(2)16(9-11)22(18,19)17-13-7-8-14(20-3)15(10-13)21-4/h5-10,17H,1-4H3
InChI Key:
CGSKJLWYBKINBN-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)NS(=O)(=O)c1cc(C)ccc1C
Properties
Complexity:
448
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.103g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.391g/mol
Monoisotopic Mass:
321.103g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
73A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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