| CAS Number | 328028-33-7 |
| Catalog Number | AG00I69H(AGN-PC-0WQYGA) |
| Chemical Name | 2,5-diamino-N-(2-chlorophenyl)benzenesulfonamide |
| IUPAC Name | 2,5-diamino-N-(2-chlorophenyl)benzenesulfonamide |
| InChI | InChI=1S/C12H12ClN3O2S/c13-9-3-1-2-4-11(9)16-19(17,18)12-7-8(14)5-6-10(12)15/h1-7,16H,14-15H2 |
| InChI Key | JITPMZCIAFVJHS-UHFFFAOYSA-N |
| MDL Number | MFCD02704630 |
| Molecular Formula | C12H12ClN3O2S |
| Molecular Weight | 297.7606 |
| SMILES | NC1=CC(S(NC2=C(Cl)C=CC=C2)(=O)=O)=C(N)C=C1 |
| Synonyms | 2,5-diamino-N-(2-chlorophenyl)benzenesulfonamide,
328028-33-7,
2,5-diamino-N-(2-chlorophenyl)benzene-1-sulfonamide,
AC1NLQ3W,
AC1Q521R,
CTK7D6996,
ZINC3887200,
MFCD02704630,
AKOS034454523,
MCULE-2056508674,
NE23637,
EN300-08049,
SR-01000028565,
SR-01000028565-1,
Z56785506,
ZINC03887200,
CID4987471,
|
| Complexity | 398 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 297.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 297.757g/mol |
| Monoisotopic Mass | 297.034g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 107A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number