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MCULE-2457209929
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 | 272 USD | 97 | 27 working days | Get Quote |
| 5 mg | 272 USD | 97 | 27 working days | Get Quote |
| 10 mg | 332 USD | N/A | 12 working days | Get Quote |
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1
MCULE-9103797903
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2457209929.sdf |
| SMILES | MCULE-2457209929.smiles |
| Standard InChI | MCULE-2457209929.inchi |
| InChIKey | MCULE-2457209929.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596563409 | Key Organics | Building Blocks | 97 | As is | 5 mg |
| P-500412690 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-893891856 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-893301525 | Allbio Pharm | In stock | N/A | Main component | in stock |
| P-596584377 | Key Organics | Building Blocks | 97 | Main component | 5 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 441.360 |
| logP | 2.1198 |
| H-bond acceptors | 8 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 103.7 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 102.5862 |
| Atoms | 49 |
| Rings | 4 |
| Heavy atoms | 31 |
| Hydrogen atoms | 18 |
| Heteroatoms | 11 |
| N/O atoms | 8 |
| Inorganic atoms | 1 |
| Halogen atoms | 2 |
| 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 |
