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MCULE-9417454541-0
Structure
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- InChIKey:
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- 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 | 166 USD | 99 | 20 working days | Get Quote |
| 5 mg | 366 USD | 98 | 16 working days | Get Quote |
| 10 mg | 452 USD | 95 | 12 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9417454541-0.sdf |
| SMILES | MCULE-9417454541-0.smiles |
| Standard InChI | MCULE-9417454541-0.inchi |
| InChIKey | MCULE-9417454541-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892954129 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867555609 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875714468 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869338400 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-893618796 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.1 g |
| P-596991845 | Angene | Building Blocks in stock | 99 | As is | 100 mg |
| P-864158116 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-871218572 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-851239431 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861347021 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580338829 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-500154996 | J&W Pharmlab | In-stock compounds | 98 | As is | in stock |
| P-596582434 | Key Organics | Building Blocks | 95 | As is | 100 mg |
| P-615648430 | LabNetwork | In stock | 95 | As is | in stock |
| P-854715606 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-896627894 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-871070147 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-878644466 | Molnova | Stock | 98 | As is | in stock |
| P-893933948 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 354.402 |
| logP | 3.5956 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 105.51 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 100.0538 |
| Atoms | 48 |
| Rings | 4 |
| Heavy atoms | 26 |
| Hydrogen atoms | 22 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |
