| CAS Number | 325724-64-9 |
| Catalog Number | AG019H0V |
| Chemical Name | 3-amino-4-chloro-N-(2-methoxyphenyl)benzene-1-sulfonamide |
| IUPAC Name | 3-amino-4-chloro-N-(2-methoxyphenyl)benzenesulfonamide |
| InChI | InChI=1S/C13H13ClN2O3S/c1-19-13-5-3-2-4-12(13)16-20(17,18)9-6-7-10(14)11(15)8-9/h2-8,16H,15H2,1H3 |
| InChI Key | OXLXBFFFWUZIFQ-UHFFFAOYSA-N |
| MDL Number | MFCD02702401 |
| Molecular Formula | C13H13ClN2O3S |
| Molecular Weight | 312.7719 |
| SMILES | COC1=C(NS(C2=CC(N)=C(Cl)C=C2)(=O)=O)C=CC=C1 |
| Synonyms | 3-amino-4-chloro-N-(2-methoxyphenyl)benzene-1-sulfonamide,
325724-64-9,
3-Amino-4-chloro-N-(2-methoxy-phenyl)-benzenesulfonamide,
AC1MX0GN,
3-amino-4-chloro-N-(2-methoxyphenyl)benzenesulfonamide,
SCHEMBL13577033,
CTK7B1567,
AC1Q4669,
ZINC3885357,
AKOS000115616,
MCULE-3843566923,
NE12165,
EN300-02135,
Z56771860,
CID3807992,
|
| 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