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MCULE-7878709041
Compound
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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 | 88 USD | 90 | 27 working days | Get Quote |
| 5 mg | 105 USD | 90 | 27 working days | Get Quote |
| 10 mg | 117 USD | 90 | 27 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-7878709041.sdf |
| SMILES | MCULE-7878709041.smiles |
| Standard InChI | MCULE-7878709041.inchi |
| InChIKey | MCULE-7878709041.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867426918 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-853427584 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851677770 | AmBeed | On request | N/A | As is | by synthesis |
| P-590878919 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-868549939 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580373773 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-862027582 | FluoroChem | General BB | N/A | As is | in stock |
| P-14819433 | Life Chemicals | Screening Compounds | 90 | As is | 2.03 g |
| P-468070867 | Life Chemicals | Building Blocks | 95 | As is | 2.03 g |
| P-852509865 | Matrix Scientific | All | N/A | As is | in stock |
| P-611378305 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 242.273 |
| logP | 2.7825 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 62.22 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 69.4155 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
