1. Primary Information
| English name: | Bazedoxifene acetate |
| CAS No.: | 198481-33-3 |
| Molecular formula: | C32H38N2O5 |
| Molecular weight: | 530.7 g/mol |
| SMILES: | CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)OCCN4CCCCCC4)C5=CC=C(C=C5)O.CC(=O)O |
| Structural class: | |
| Other identifiers: |
bazedoxifene bazedoxifene acetate TSE 424 TSE-424 TSE424 |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 5mg | 99% | 520 | -20℃ | in stock | - |
| Kehua Intelligence | 10mg | 99% | 960 | -20℃ | in stock | - |
| Kehua Intelligence | 25mg | 99% | 1920 | -20℃ | in stock | - |
| Kehua Intelligence | 50mg | 99% | 3360 | -20℃ | in stock | - |
| Kehua Intelligence | 100mg | 99% | 5440 | -20℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
acetic acid;1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-2-(4-hydroxyphenyl)-3-methylindol-5-ol
4.2 InChI
InChI=1S/C30H34N2O3.C2H4O2/c1-22-28-20-26(34)12-15-29(28)32(30(22)24-8-10-25(33)11-9-24)21-23-6-13-27(14-7-23)35-19-18-31-16-4-2-3-5-17-31;1-2(3)4/h6-15,20,33-34H,2-5,16-19,21H2,1H3;1H3,(H,3,4)
4.3 InChIKey
OMZAMQFQZMUNTP-UHFFFAOYSA-N
4.4 Canonical SMILES
CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)OCCN4CCCCCC4)C5=CC=C(C=C5)O.CC(=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 --
