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MCULE-9290790000
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 | 45 USD | 90 | 23 working days | Get Quote |
| 5 mg | 72 USD | 90 | 23 working days | Get Quote |
| 10 mg | 87 USD | 90 | 23 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-9290790000.sdf |
| SMILES | MCULE-9290790000.smiles |
| Standard InChI | MCULE-9290790000.inchi |
| InChIKey | MCULE-9290790000.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596514091 | Asinex | General bb catalog | 90 | As is | 94 mg |
| P-596395853 | Asinex | General screening catalog | 90 | As is | 94 mg |
| P-563704591 | Key Organics | Building Blocks | 95 | As is | 100 mg |
| P-629286878 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-12815873 | Otava | In-House Stock Library | 90 | As is | 1.44 g |
| P-492283231 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.44 g |
| P-502338340 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-23211888 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 3 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 299.353 |
| logP | 3.251 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 124.4 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 84.5093 |
| Atoms | 34 |
| Rings | 3 |
| Heavy atoms | 21 |
| Hydrogen atoms | 13 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
