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MCULE-7040519498-1
Structure
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- InChI:
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| 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 | 34 USD | 95 | 20 working days | Get Quote |
| 5 mg | 34 USD | 95 | 20 working days | Get Quote |
| 10 mg | 34 USD | 95 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-7040519498-1.sdf |
| SMILES | MCULE-7040519498-1.smiles |
| Standard InChI | MCULE-7040519498-1.inchi |
| InChIKey | MCULE-7040519498-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867630069 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875793440 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-875890500 | Angene | Building Blocks in stock | 95 | As is | 23.75 g |
| P-494301910 | BioBlocks | In stock | 95 | As is | in stock |
| P-861438871 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580437108 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-454407157 | Key Organics | Building Blocks | 95 | As is | 184 mg |
| P-454329399 | Key Organics | Screening Compounds and Fragments | 95 | As is | 184 mg |
| P-894000699 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 175.183 |
| logP | 1.9544 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 53.35 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 50.755 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 9 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
