| CAS Number | 1633009-87-6 |
| Catalog Number | AG00AST7 |
| Chemical Name | BI 689648 |
| IUPAC Name | 6-[5-(methoxymethyl)pyridin-3-yl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide |
| InChI | InChI=1S/C16H18N4O2/c1-22-10-11-5-13(8-18-7-11)14-6-12-3-2-4-20(16(17)21)15(12)19-9-14/h5-9H,2-4,10H2,1H3,(H2,17,21) |
| InChI Key | DJFDCVNQDFICKV-UHFFFAOYSA-N |
| MDL Number | MFCD28502113 |
| Molecular Formula | C16H18N4O2 |
| Molecular Weight | 298.3397 |
| SMILES | N1(C(N)=O)C2=C(C=C(C3=CC(COC)=CN=C3)C=N2)CCC1 |
| Synonyms | 6-(5-methoxymethylpyridin-3-yl)-3,4-dihydro-2H-(1,8)naphthyridine-1-carboxylic acid amide,
BI 689648,
BI 689648,
1633009-87-6,
BI-689648,
CHEMBL3891562,
SCHEMBL16196701,
BDBM191246,
BCP25187,
CS-8022,
SB17048,
BI689648,
HY-101217,
US9181272, 16,
|
| Complexity | 392 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 298.143g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 298.346g/mol |
| Monoisotopic Mass | 298.143g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 81.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number