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MCULE-2719975445
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 | 130 USD | 90 | 27 working days | Get Quote |
| 5 mg | 130 USD | 90 | 27 working days | Get Quote |
| 10 mg | 130 USD | 90 | 27 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-2719975445.sdf |
| SMILES | MCULE-2719975445.smiles |
| Standard InChI | MCULE-2719975445.inchi |
| InChIKey | MCULE-2719975445.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-885969516 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-851822927 | AmBeed | On request | N/A | As is | by synthesis |
| P-611145843 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-888624640 | Key Organics | Building Blocks | 95 | As is | 1 mg |
| P-596561667 | Key Organics | Building Blocks | 97 | As is | 42 mg |
| P-868120303 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 3.01 g |
| P-19356196 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-596714621 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 20 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 440.873 |
| logP | 3.1469 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 7 |
| PSA | 88.7 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 119.0102 |
| Atoms | 52 |
| Rings | 4 |
| Heavy atoms | 31 |
| Hydrogen atoms | 21 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
