| CAS Number | 1449598-06-4 |
| Catalog Number | AG01EOPS(AGN-PC-0WGD9Q) |
| Chemical Name | RG7800 |
| IUPAC Name | 2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)-9-methyl-7-(1-methylpiperidin-4-yl)pyrido[1,2-a]pyrimidin-4-one |
| InChI | InChI=1S/C24H28N6O/c1-5-19-22-11-21(27-30(22)13-16(3)25-19)20-12-23(31)29-14-18(10-15(2)24(29)26-20)17-6-8-28(4)9-7-17/h10-14,17H,5-9H2,1-4H3 |
| InChI Key | GYFRQCMDLBNZSF-UHFFFAOYSA-N |
| MDL Number | MFCD31382130 |
| Molecular Formula | C24H28N6O |
| Molecular Weight | 416.5187 |
| SMILES | C12C(C)=CC(C3CCN(C)CC3)=CN1C(=O)C=C(C1C=C3N(N=1)C=C(C)N=C3CC)N=2 |
| Synonyms | RG7800,
1449598-06-4,
SCHEMBL15176425,
EX-A2562,
CS-6478,
HY-101792,
RO6885247; RG7800,
2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)-9-methyl-7-(1-methylpiperidin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one,
RO6885247,
|
| Complexity | 865 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 416.232g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 31 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 416.529g/mol |
| Monoisotopic Mass | 416.232g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 66.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number