| CAS Number | 680591-13-3 |
| Catalog Number | AG00IS2L(AGN-PC-0BURCD) |
| Chemical Name | N-(6-methoxypyridin-3-yl)-2-methylbenzene-1-sulfonamide |
| IUPAC Name | N-(6-methoxypyridin-3-yl)-2-methylbenzenesulfonamide |
| InChI | InChI=1S/C13H14N2O3S/c1-10-5-3-4-6-12(10)19(16,17)15-11-7-8-13(18-2)14-9-11/h3-9,15H,1-2H3 |
| InChI Key | YOSUCWMJWWAHDI-UHFFFAOYSA-N |
| MDL Number | MFCD14861386 |
| Molecular Formula | C13H14N2O3S |
| Molecular Weight | 278.3269 |
| SMILES | S(=O)(=O)(NC1(=CN=C(OC)C=C1))C2(=C(C=CC=C2)C) |
| Synonyms | 680591-13-3,
N-(6-methoxypyridin-3-yl)-2-methylbenzene-1-sulfonamide,
N-(6-Methoxy-pyridin-3-yl)-2-methyl-benzenesulfonamide,
SCHEMBL1036983,
YOSUCWMJWWAHDI-UHFFFAOYSA-N,
KS-000023PH,
ZINC36078112,
AKOS012298190,
CD-0111,
MCULE-8106726997,
N-(6-Methoxypyridin-3-yl)-2-methylbenzenesulfonamide,
|
| Complexity | 380 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 278.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.326g/mol |
| Monoisotopic Mass | 278.073g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 76.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number