| CAS Number | 438018-01-0 |
| Catalog Number | AG019H18 |
| Chemical Name | 5-amino-2-chloro-N-(2-methoxyphenyl)benzene-1-sulfonamide |
| IUPAC Name | 5-amino-2-chloro-N-(2-methoxyphenyl)benzenesulfonamide |
| InChI | InChI=1S/C13H13ClN2O3S/c1-19-12-5-3-2-4-11(12)16-20(17,18)13-8-9(15)6-7-10(13)14/h2-8,16H,15H2,1H3 |
| InChI Key | OGGZSFADAOUQSI-UHFFFAOYSA-N |
| MDL Number | MFCD03147577 |
| Molecular Formula | C13H13ClN2O3S |
| Molecular Weight | 312.7719 |
| SMILES | COC1=C(NS(C2=C(Cl)C=CC(N)=C2)(=O)=O)C=CC=C1 |
| Synonyms | 5-amino-2-chloro-N-(2-methoxyphenyl)benzene-1-sulfonamide,
438018-01-0,
5-Amino-2-chloro-N-(2-methoxy-phenyl)-benzenesulfonamide,
AC1NMY5C,
AC1Q466A,
CTK7B1558,
ZINC3885382,
AKOS000115485,
MCULE-6999864097,
NE12362,
EN300-02161,
Z56839653,
5-amino-2-chloro-N-(2-methoxyphenyl)benzenesulfonamide,
ZINC03885382,
CID5017986,
|
| Complexity | 412 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 312.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 312.768g/mol |
| Monoisotopic Mass | 312.034g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 89.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number