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MCULE-5997042459
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 | 143 USD | 98 | 22 working days | Get Quote |
| 5 mg | 143 USD | 98 | 22 working days | Get Quote |
| 10 mg | 143 USD | 98 | 22 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-5997042459.sdf |
| SMILES | MCULE-5997042459.smiles |
| Standard InChI | MCULE-5997042459.inchi |
| InChIKey | MCULE-5997042459.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886600801 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-901195304 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-613849859 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851586147 | AmBeed | On request | N/A | As is | by synthesis |
| P-489230033 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-864281744 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590827327 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-901546840 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-861556583 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580297705 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-854840775 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-855213113 | Toronto Research | In stock | 90 | As is | in stock |
| P-886920604 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 233.219 |
| logP | 2.0492 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 91.85 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 51.629 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 8 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
