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Home > Sulfanilamide > 672950-12-8
672950-12-8 | N-(2,3-dimethylquinoxalin-6-yl)-4-methoxybenzene-1-sulfonamide
CAS No: 672950-12-8 Catalog No: AG00IPVR MDL No:MFCD02187184
Product Description
Catalog Number:
AG00IPVR
Chemical Name:
N-(2,3-dimethylquinoxalin-6-yl)-4-methoxybenzene-1-sulfonamide
CAS Number:
672950-12-8
Molecular Formula:
C17H17N3O3S
Molecular Weight:
343.4002
MDL Number:
MFCD02187184
IUPAC Name:
N-(2,3-dimethylquinoxalin-6-yl)-4-methoxybenzenesulfonamide
InChI:
InChI=1S/C17H17N3O3S/c1-11-12(2)19-17-10-13(4-9-16(17)18-11)20-24(21,22)15-7-5-14(23-3)6-8-15/h4-10,20H,1-3H3
InChI Key:
BCSWUQHFORNDMP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)nc(c(n2)C)C
Properties
Complexity:
514
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.099g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
343.401g/mol
Monoisotopic Mass:
343.099g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
89.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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