| CAS Number | 1708971-72-5 |
| Catalog Number | AG00ABRL(AGN-PC-0WNHDQ) |
| Chemical Name | FGFR4-IN-1 |
| IUPAC Name | N-[5-cyano-4-(2-methoxyethylamino)pyridin-2-yl]-7-formyl-6-[(3-oxomorpholin-4-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide |
| InChI | InChI=1S/C24H27N7O5/c1-35-7-4-26-19-10-21(27-12-18(19)11-25)29-24(34)31-5-2-3-16-9-17(20(14-32)28-23(16)31)13-30-6-8-36-15-22(30)33/h9-10,12,14H,2-8,13,15H2,1H3,(H2,26,27,29,34) |
| InChI Key | ZTYSXMGILYNNJX-UHFFFAOYSA-N |
| MDL Number | MFCD30489746 |
| Molecular Formula | C24H27N7O5 |
| Molecular Weight | 493.5151 |
| SMILES | O=C(NC1=NC=C(C#N)C(NCCOC)=C1)N2CCCC3=CC(CN4CCOCC4=O)=C(C=O)N=C32 |
| Synonyms | FGFR4-IN-1,
1708971-72-5,
N-(5-cyano-4-((2-methoxyethyl)amino)pyridin-2-yl)-7-formyl-6-((3-oxomorpholino)methyl)-3,4-dihydro-1,8-naphthyridine-1(2H)-carboxamide,
CHEMBL3968334,
SCHEMBL16668616,
BDBM209334,
BCP19061,
EX-A1133,
MFCD30489746,
AKOS030632032,
ZINC575623810,
CS-5897,
HY-100631,
US9266883, 98,
A16251,
|
| Complexity | 835 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 493.207g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 36 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 493.524g/mol |
| Monoisotopic Mass | 493.207g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 150A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number