| CAS Number | 568566-61-0 |
| Catalog Number | AG019IBP |
| Chemical Name | N,N-dibenzyl-6-chloropyridine-3-sulfonamide |
| IUPAC Name | N,N-dibenzyl-6-chloropyridine-3-sulfonamide |
| InChI | InChI=1S/C19H17ClN2O2S/c20-19-12-11-18(13-21-19)25(23,24)22(14-16-7-3-1-4-8-16)15-17-9-5-2-6-10-17/h1-13H,14-15H2 |
| InChI Key | SYFRVJLBPHIPGZ-UHFFFAOYSA-N |
| MDL Number | MFCD03504902 |
| Molecular Formula | C19H17ClN2O2S |
| Molecular Weight | 372.8685 |
| SMILES | ClC1=NC=C(S(N(CC2=CC=CC=C2)CC2=CC=CC=C2)(=O)=O)C=C1 |
| Synonyms | N,N-dibenzyl-6-chloropyridine-3-sulfonamide,
6-Chloro-pyridine-3-sulfonic acid dibenzylamide,
568566-61-0,
Enamine_005639,
AC1M6ZWO,
AC1Q3JDW,
MLS000394140,
CHEMBL1390030,
CTK6H1486,
HMS1410A07,
HMS2539G19,
ZINC3317475,
AKOS000117108,
MCULE-6717485300,
NE20505,
IDI1_007874,
SMR000247770,
EN300-06268,
ZINC03317475,
CID2433225,
|
| Complexity | 476 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 372.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 372.867g/mol |
| Monoisotopic Mass | 372.07g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number