| CAS Number | 349122-26-5 |
| Catalog Number | AG019EXT |
| Chemical Name | 4-bromo-N-(2-methoxy-5-methylphenyl)benzene-1-sulfonamide |
| IUPAC Name | 4-bromo-N-(2-methoxy-5-methylphenyl)benzenesulfonamide |
| InChI | InChI=1S/C14H14BrNO3S/c1-10-3-8-14(19-2)13(9-10)16-20(17,18)12-6-4-11(15)5-7-12/h3-9,16H,1-2H3 |
| InChI Key | KAZHRSUUCXUBQU-UHFFFAOYSA-N |
| MDL Number | MFCD01964807 |
| Molecular Formula | C14H14BrNO3S |
| Molecular Weight | 356.2349 |
| SMILES | COc1ccc(C)cc1NS(=O)(=O)c1ccc(Br)cc1 |
| Synonyms | 4-bromo-N-(2-methoxy-5-methylphenyl)benzenesulfonamide,
349122-26-5,
AC1M8UGE,
ZINC3376573,
MFCD01964807,
STK917611,
AKOS000383585,
MCULE-1702713550,
SC-56662,
CS-0061231,
ST51013562,
4-Bromo-N-(2-methoxy-5-methyl-phenyl)-benzenesulfo,
4-Bromo-N-(2-methoxy-5-methylphenyl)-benzenesulfonamide,
[(4-bromophenyl)sulfonyl](2-methoxy-5-methylphenyl)amine,
ZINC03376573,
CID2494543,
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| Complexity | 401 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 354.988g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 356.234g/mol |
| Monoisotopic Mass | 354.988g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 63.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number