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Imatinib · CAS 152459-95-5 · C29H31N7O. UNII BKJ8M8G5HI. Melting Point: 226; Melting Point: 226 °C (mesylate salt); Solubility: 1.46e-02 g/L.
| CAS Registry Number | 152459-95-5 |
|---|---|
| PubChem CID | 5291 |
| Molecular formula | C29H31N7O |
| IUPAC name | 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide |
| UNII (FDA) | BKJ8M8G5HI |
| Molecular Weight | 493.6 |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 493.25900864 |
| Monoisotopic Mass | 493.25900864 |
| Topological Polar Surface Area | 86.3 |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Melting Point | 226 |
|---|---|
| Melting Point | 226 °C (mesylate salt) |
| Solubility | 1.46e-02 g/L |
| LogP | 3.42 |
| Reported hazard statements | H315 (18.2%), H319 (18.2%), H341 (72.7%), H351 (72.7%), H360 (63.6%), H362 (72.7%) |
|---|
H315 (18.2%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (18.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Imatinib; 152459-95-5; N-(4-Methyl-3-((4-(pyridin-3-yl)pyrimidin-2-yl)amino)phenyl)-4-((4-methylpiperazin-1-yl)methyl)benzamide; Glamox; BKJ8M8G5HI; 4-[(4-methyl-1-piperazinyl)methyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide; NSC-743414; NSC-759854; N-(4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)-4-[(4-methylpiperazin-1-yl)methyl]benzamide; DTXSID3037125; CHEBI:45783; Benzamide, 4-((4-methyl)-1-piperazinyl)methyl)-N-(4-methyl-3-((4-(3-pyridinyl)-2-pyrimidinyl)amino)phenyl)-; alpha-(4-methyl-1-piperazinyl)-3'-((4-(3-pyridyl)-2-pyrimidinyl)amino)-p-toluidide; Imatinibum; 4-((4-Methyl-1-piperazinyl)methyl)-N-(4-methyl-3-((4-(3-pyridinyl)-2-pyrimidinyl)amino)phenyl)benzamide; RefChem:76
CAS 152459-95-5; molecular formula C29H31N7O; molecular weight — g/mol.
Imatinib, 152459-95-5, N-(4-Methyl-3-((4-(pyridin-3-yl)pyrimidin-2-yl)amino)phenyl)-4-((4-methylpiperazin-1-yl)methyl)benzamide, Glamox, BKJ8M8G5HI, 4-[(4-methyl-1-piperazinyl)methyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide.
Hazard statements reported: H315, H319, H341, H351, H360.
Melting Point: 226; Melting Point: 226 °C (mesylate salt); Solubility: 1.46e-02 g/L; LogP: 3.42.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.