| CAS Number | 188480-50-4 |
| Catalog Number | AG002GWR(AGN-PC-0J236K) |
| Chemical Name | 4-(Hydroxyamino)-N-(2-(naphthalen-2-yloxy)ethyl)benzenesulfonamide |
| IUPAC Name | 4-(hydroxyamino)-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide |
| InChI | InChI=1S/C18H18N2O4S/c21-20-16-6-9-18(10-7-16)25(22,23)19-11-12-24-17-8-5-14-3-1-2-4-15(14)13-17/h1-10,13,19-21H,11-12H2 |
| InChI Key | WPPIAVCIUZNQCQ-UHFFFAOYSA-N |
| MDL Number | MFCD28160789 |
| Molecular Formula | C18H18N2O4S |
| Molecular Weight | 358.4115 |
| SMILES | ONc1ccc(cc1)S(=O)(=O)NCCOc1ccc2ccccc2c1 |
| Synonyms | SCH-53870,
188480-50-4,
4-(Hydroxyamino)-N-(2-(naphthalen-2-yloxy)ethyl)benzenesulfonamide,
Benzenesulfonamide, 4-(hydroxyamino)-N-[2-(2-naphthalenyloxy)ethyl]-,
CHEMBL2086790,
MFCD28160789,
ZINC84731208,
AKOS025117582,
KS-0000019K,
4-(Hydroxyamino)-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide,
Benzenesulfonamide,4-(hydroxyamino)-N-[2-(2-naphthalenyloxy)ethyl]-,
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| Complexity | 500 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 358.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 358.412g/mol |
| Monoisotopic Mass | 358.099g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 96A^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