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MCULE-8100165546
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.
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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 | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 working days | Get Quote |
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1
MCULE-4802155492
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8100165546.sdf |
| SMILES | MCULE-8100165546.smiles |
| Standard InChI | MCULE-8100165546.inchi |
| InChIKey | MCULE-8100165546.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867293458 | A2B Chem | Predominantly Building Block on demand | 97 | Main component | by synthesis |
| P-874587325 | ChemDiv | Discovery Chemistry Library | 90 | Main component | in stock |
| P-580317072 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-488554062 | InterBioScreen | Building Blocks | 90 | Main component | in stock |
| P-24462736 | InterBioScreen | Screening Compounds | 92 | Main component | 300 mg |
| P-454374605 | Pharmeks LLC | Building Blocks | 92 | Main component | in stock |
| P-34212782 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-491205178 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-24767085 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 1.009 g |
| P-464686426 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | Main component | 1.009 g |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 322.228 |
| logP | 2.8448 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 67.59 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 87.5896 |
| Atoms | 41 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 21 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
