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UNKNOWN STEREO
MCULE-7449957572-1
Structure
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- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 5 USD | 99 | 20 working days | Get Quote |
| 5 mg | 5 USD | 99 | 20 working days | Get Quote |
| 10 mg | 5 USD | 99 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-3942804599-0
- Component type: Main
-
1
MCULE-5646000632-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7449957572-1.sdf |
| SMILES | MCULE-7449957572-1.smiles |
| Standard InChI | MCULE-7449957572-1.inchi |
| InChIKey | MCULE-7449957572-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-885359456 | AmBeed | On request | N/A | As is | by synthesis |
| P-867662891 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-875832253 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-889055306 | AK Scientific | Building Blocks | 99 | Main component | in stock |
| P-580197805 | Aldlab Chemicals | Building Block Stock | 95 | Main component | 5.442 kg |
| P-606909155 | AmBeed | In stock | N/A | Main component | in stock |
| P-606921719 | AmBeed | In stock | N/A | Main component | in stock |
| P-596933830 | Angene | Building Blocks in stock | 99 | Main component | 225 kg |
| P-864136572 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-864183711 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-580288578 | Debye Scientific | General Catalog | N/A | Main component | by resynthesis (? - ? days) |
| P-890204780 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | Main component | in stock |
| P-579484446 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | Main component | in stock |
| P-613332726 | Life Chemicals | Building Blocks - virtual | 95 | Main component | by synthesis |
| P-620068193 | Otava | In-House Stock Library | 90 | Main component | 1000 mg |
| P-594274048 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892295669 | TargetMol | In Stock BB | 95 | Main component | 1000 mg |
| P-892338062 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 1000 mg |
| P-855071587 | Toronto Research | In stock | 90 | Main component | in stock |
| P-575326114 | eNovation Chemicals LLC | Building Blocks in stock | 98 | Main component | in stock |
| P-875736780 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-616207918 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-869230108 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-619129901 | Angene | Building Blocks in stock | 95 | Main component as a main component | 200 g |
| P-864196995 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 167.117 |
| logP | -1.7987 |
| H-bond acceptors | 7 |
| H-bond donors | 5 |
| Rotatable bonds | 3 |
| PSA | 118.3 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 31.9363 |
| Atoms | 20 |
| Rings | 0 |
| Heavy atoms | 11 |
| Hydrogen atoms | 9 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
