| CAS Number | 281209-71-0 |
| Catalog Number | AG00BJY2(AGN-PC-0R3PS1) |
| Chemical Name | Compound 2 |
| IUPAC Name | N-tert-butyl-6,7-dichloro-3-methylsulfonylquinoxalin-2-amine |
| InChI | InChI=1S/C13H15Cl2N3O2S/c1-13(2,3)18-11-12(21(4,19)20)17-10-6-8(15)7(14)5-9(10)16-11/h5-6H,1-4H3,(H,16,18) |
| InChI Key | GNZCSGYHILBXLL-UHFFFAOYSA-N |
| MDL Number | MFCD11521508 |
| Molecular Formula | C13H15Cl2N3O2S |
| Molecular Weight | 348.2481 |
| SMILES | Clc1cc2nc(c(nc2cc1Cl)NC(C)(C)C)S(=O)(=O)C |
| Synonyms | N-(tert-Butyl)-6,7-dichloro-3-(methylsulfonyl)quinoxalin-2-amine,
281209-71-0,
CHEMBL398714,
N-tert-butyl-6,7-dichloro-3-(methylsulfonyl)quinoxalin-2-amine,
GLP-1R agonist DMB,
SCHEMBL2555049,
HMS3740K03,
BDBM50202222,
ZINC28951019,
NCGC00386659-01,
DB-110032,
N-tert-Butyl-3-mesyl-6,7-dichloroquinoxaline-2-amine,
GLP-1R agonist DMB - DMB,
GNZCSGYHILBXLL-UHFFFAOYSA-N,
DMB,
|
| Complexity | 475 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 347.026203g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 348.2g/mol |
| Monoisotopic Mass | 347.026203g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 80.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number