1. Primary Information
| English name: | Osimertinib Mesylate |
| CAS No.: | 1421373-66-1 |
| Molecular formula: | C29H37N7O5S |
| Molecular weight: | 595.7 g/mol |
| SMILES: | CN1C=C(C2=CC=CC=C21)C3=NC(=NC=C3)NC4=C(C=C(C(=C4)NC(=O)C=C)N(C)CCN(C)C)OC.CS(=O)(=O)O |
| Structural class: | |
| Other identifiers: |
AZD-9291 AZD-9291 mesylate AZD9291 AZD9291 mesylate mereletinib |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 2mg | 99% | 166 | -20℃ | in stock | - |
| Kehua Intelligence | 5mg | 99% | 294 | -20℃ | in stock | - |
| Kehua Intelligence | 10mg | 99% | 428 | -20℃ | in stock | - |
| Kehua Intelligence | 25mg | 99% | 576 | -20℃ | in stock | - |
| Kehua Intelligence | 50mg | 99% | 960 | -20℃ | in stock | - |
| Kehua Intelligence | 100mg | 99% | 1408 | -20℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[4-(1-methylindol-3-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide;methanesulfonic acid
4.2 InChI
InChI=1S/C28H33N7O2.CH4O3S/c1-7-27(36)30-22-16-23(26(37-6)17-25(22)34(4)15-14-33(2)3)32-28-29-13-12-21(31-28)20-18-35(5)24-11-9-8-10-19(20)24;1-5(2,3)4/h7-13,16-18H,1,14-15H2,2-6H3,(H,30,36)(H,29,31,32);1H3,(H,2,3,4)
4.3 InChIKey
FUKSNUHSJBTCFJ-UHFFFAOYSA-N
4.4 Canonical SMILES
CN1C=C(C2=CC=CC=C21)C3=NC(=NC=C3)NC4=C(C=C(C(=C4)NC(=O)C=C)N(C)CCN(C)C)OC.CS(=O)(=O)O
4.5 Isomeric SMILES
-
4.6 SDF file
Coming soon
5. Spectroscopic data
5.1 13C nuclear magnetic resonance (13C NMR)
5.2 1H nuclear magnetic resonance (1H NMR)
5.3 Mass spectrometry (MS)
Coming soon
5.4 Infrared spectroscopy (IR)
Coming soon
5.5 Ultraviolet/visible spectroscopy (UV/Vis)
Coming soon
-- No 3D model data available --
