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MCULE-6663563439
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 | 37 USD | 90 | 19 working days | Get Quote |
| 5 mg | 54 USD | 90 | 19 working days | Get Quote |
| 10 mg | 69 USD | 90 | 19 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-6663563439.sdf |
| SMILES | MCULE-6663563439.smiles |
| Standard InChI | MCULE-6663563439.inchi |
| InChIKey | MCULE-6663563439.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886521382 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-886663080 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-869270385 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-866729461 | Apollo Scientific | In Stock | 95 | As is | 50 g |
| P-454756556 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-607694818 | ChemDiv | Discovery Chemistry Library | 90 | As is | 30 mg |
| P-34458876 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580765629 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
| P-580776232 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-502537951 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-856001916 | Key Organics | Screening Compounds and Fragments | 90 | As is | 100 mg |
| P-580483323 | Manchester Organics | Compounds on demand | 95 | As is | by synthesis |
| P-23859114 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491128734 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502342415 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-596526159 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.073 g |
| P-1144061 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.073 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 214.165 |
| logP | 2.3858 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 46.53 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 49.7058 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
