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MCULE-4972124463
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 | 155 USD | 95 | 14 working days | Get Quote |
| 5 mg | 155 USD | 95 | 14 working days | Get Quote |
| 10 mg | 155 USD | 95 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-7675306054
- Component type: Main
-
1
MCULE-8295936189
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4972124463.sdf |
| SMILES | MCULE-4972124463.smiles |
| Standard InChI | MCULE-4972124463.inchi |
| InChIKey | MCULE-4972124463.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-888621642 | Key Organics | Building Blocks | 95 | As is | 50 mg |
| P-855983789 | Key Organics | Building Blocks | 97 | Main component | 500 mg |
| P-596581086 | Key Organics | Building Blocks | 97 | Main component | 100 mg |
| P-31194704 | LaboTest | Screening Collection | 90 | Main component | unavailable |
| P-635687191 | Otava | Tangible screening compounds | 90 | Main component | by synthesis |
| P-885541257 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 354.398 |
| logP | 2.0596 |
| H-bond acceptors | 8 |
| H-bond donors | 5 |
| Rotatable bonds | 8 |
| PSA | 149.95 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 92.8677 |
| Atoms | 51 |
| Rings | 1 |
| Heavy atoms | 25 |
| Hydrogen atoms | 26 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
