| CAS Number | 1243245-18-2 |
| Catalog Number | AG009CMZ(AGN-PC-0WNHD3) |
| Chemical Name | GNF-6231 |
| IUPAC Name | N-[5-(4-acetylpiperazin-1-yl)pyridin-2-yl]-2-[6-(2-fluoropyridin-4-yl)-5-methylpyridin-3-yl]acetamide |
| InChI | InChI=1S/C24H25FN6O2/c1-16-11-18(14-28-24(16)19-5-6-26-21(25)13-19)12-23(33)29-22-4-3-20(15-27-22)31-9-7-30(8-10-31)17(2)32/h3-6,11,13-15H,7-10,12H2,1-2H3,(H,27,29,33) |
| InChI Key | AXXNRMISICMFNS-UHFFFAOYSA-N |
| MDL Number | MFCD30343851 |
| Molecular Formula | C24H25FN6O2 |
| Molecular Weight | 448.4927 |
| SMILES | O=C(NC1=NC=C(N2CCN(C(C)=O)CC2)C=C1)CC3=CN=C(C4=CC(F)=NC=C4)C(C)=C3 |
| Synonyms | GNF-6231,
1243245-18-2,
SCHEMBL1722312,
AXXNRMISICMFNS-UHFFFAOYSA-N,
BCP25768,
AKOS030526350,
ZINC116933276,
CS-5706,
SB18871,
AK547145,
HY-100408,
A16849,
N-(5-(4-acetylpiperazin-1-yl)pyridin-2-yl)-2-(2'-fluoro-3-methyl-2,4'-bipyridin-5-yl)acetamide,
N-[5-(4-acetylpiperazin-1-yl)pyridin-2-yl]-2-[6-(2-fluoropyridin-4-yl)-5-methylpyridin-3-yl]acetamide,
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| Complexity | 673 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 448.202g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 33 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 448.502g/mol |
| Monoisotopic Mass | 448.202g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 91.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number