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MCULE-8971452449
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 | 117 USD | 90 | 8 working days | Get Quote |
| 5 mg | 234 USD | 90 | 8 working days | Get Quote |
| 10 mg | 351 USD | 90 | 8 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8971452449.sdf |
| SMILES | MCULE-8971452449.smiles |
| Standard InChI | MCULE-8971452449.inchi |
| InChIKey | MCULE-8971452449.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867307537 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-893525043 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 5 mg |
| P-891663577 | AmBeed | On request | N/A | As is | by synthesis |
| P-892190666 | Angene | Building Blocks in stock | 98 | As is | 5 mg |
| P-452657668 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-887203416 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-878208516 | Key Organics | Building Blocks | 95 | As is | 5 mg |
| P-895171804 | MedChemExpress | Natural Products on demand | 95 | As is | by synthesis |
| P-892307370 | TargetMol | Natural Products | 95 | As is | in stock |
| P-869170330 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888662865 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-33163156 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 47 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 346.287 |
| logP | 2.2996 |
| H-bond acceptors | 8 |
| H-bond donors | 4 |
| Rotatable bonds | 3 |
| PSA | 129.59 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 88.996 |
| Atoms | 39 |
| Rings | 3 |
| Heavy atoms | 25 |
| Hydrogen atoms | 14 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |
