| CAS Number | 143339-12-2 |
| Catalog Number | AG01ENRQ(AGN-PC-0PTU1Y) |
| Chemical Name | RS 056812-198 Hydrochloride |
| IUPAC Name | N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-2-(1-methylindol-3-yl)-2-oxoacetamide;hydrochloride |
| InChI | InChI=1S/C18H21N3O2.ClH/c1-20-10-14(13-4-2-3-5-16(13)20)17(22)18(23)19-15-11-21-8-6-12(15)7-9-21;/h2-5,10,12,15H,6-9,11H2,1H3,(H,19,23);1H/t15-;/m0./s1 |
| InChI Key | NHWCYXITJPBOHX-RSAXXLAASA-N |
| MDL Number | MFCD03161248 |
| Molecular Formula | C18H22ClN3O2 |
| Molecular Weight | 347.8392 |
| SMILES | C(C(N[C@@H]1C2(CCN(C1)CC2)[H])=O)(=O)C=3C=4C(N(C)C3)=CC=CC4.Cl |
| Synonyms | RS 56812 hydrochloride,
143339-12-2,
RS 56812 HCl,
SCHEMBL9470782,
AKOS024458722,
SR-01000597850,
J-007747,
SR-01000597850-1,
(R)-N-(1-Azabicyclo[2.2.2]oct-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-oxoacetamide hydrochloride,
(R)-N-(1-Azabicyclo[2.2.2]oct-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-oxoacetamidehydrochloride,
-N- -2- -2- -2-OXOACETAMIDEHYDROCHLORIDE,
143137-35-3,
|
| Complexity | 487 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 347.14g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 347.843g/mol |
| Monoisotopic Mass | 347.14g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number