| CAS Number | 1227067-61-9 |
| Catalog Number | AG01FUL3 |
| Chemical Name | AMG 579 |
| IUPAC Name | 1-[4-[3-[4-(1H-benzimidazole-2-carbonyl)phenoxy]pyrazin-2-yl]piperidin-1-yl]ethanone |
| InChI | InChI=1S/C25H23N5O3/c1-16(31)30-14-10-17(11-15-30)22-25(27-13-12-26-22)33-19-8-6-18(7-9-19)23(32)24-28-20-4-2-3-5-21(20)29-24/h2-9,12-13,17H,10-11,14-15H2,1H3,(H,28,29) |
| InChI Key | ZNPDAYJZIRPRFQ-UHFFFAOYSA-N |
| MDL Number | MFCD00133801 |
| Molecular Formula | C25H23N5O3 |
| Molecular Weight | 441.4818 |
| SMILES | C(=O)(N1CCC(C2=NC=CN=C2OC2=CC=C(C(C3=NC4=CC=CC=C4N3)=O)C=C2)CC1)C |
| UNII | XW8D2TV27D |
| Synonyms | 1-(4-(3-(4-(1H-benzo(d)imidazole-2-carbonyl)phenoxy)pyrazin-2-yl)piperidin-1-yl)ethanone,
AMG 579,
AMG 579,
AMG-579,
UNII-XW8D2TV27D,
XW8D2TV27D,
1227067-61-9,
1-(4-(3-(4-(1H-Benzo(d)imidazole-2-carbonyl)phenoxy)pyrazin-2-yl)piperidin-1-yl)ethanone,
1-(4-(3-(4-(1H-benzo[d]imidazole-2-carbonyl)phenoxy)pyrazin-2-yl)piperidin-1-yl)ethanone,
4-(3-(1-Acetylpiperidine-4-yl)pyrazine-2-yloxy)phenyl(1H-benzoimidazole-2-yl)methanone,
4-[3-(1-Acetylpiperidine-4-yl)pyrazine-2-yloxy]phenyl(1H-benzoimidazole-2-yl)methanone,
SCHEMBL1303560,
CHEMBL3319209,
ZNPDAYJZIRPRFQ-UHFFFAOYSA-N,
HY-12913,
CS-0012776,
J3.339.633C,
Q27294025,
Ethanone, 1-(4-(3-(4-(1H-benzimidazol-2-ylcarbonyl)phenoxy)-2-pyrazinyl)-1-piperidinyl)-,
|
| Complexity | 690 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 441.18009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 33 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 441.5g/mol |
| Monoisotopic Mass | 441.18009g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 101Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number