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MCULE-1761074543
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 | 30 USD | 95 | 7 working days | Get Quote |
| 5 mg | 30 USD | 95 | 7 working days | Get Quote |
| 10 mg | 37 USD | 95 | 17 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-6801100794
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1761074543.sdf |
| SMILES | MCULE-1761074543.smiles |
| Standard InChI | MCULE-1761074543.inchi |
| InChIKey | MCULE-1761074543.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903027109 | 98 | As is | 1.25 g |
| P-500414757 | 95 | As is | by synthesis |
| P-590743475 | 97 | As is | by synthesis |
| P-1263155924 | 95 | As is | by synthesis |
| P-895183013 | 95 | As is | in stock |
| P-896072404 | 95 | As is | in stock |
| P-615695699 | 98 | As a main component | by synthesis |
| P-895199934 | 95 | As a main component | by synthesis |
| P-886526211 | N/A | As an isomer | in stock |
| P-872830219 | 98 | As an isomer | in stock |
| P-852197420 | N/A | As an isomer | by synthesis |
| P-852197342 | N/A | As an isomer | by synthesis |
| P-852197414 | N/A | As an isomer | by synthesis |
| P-867456250 | N/A | As an isomer | by synthesis |
| P-893568345 | 90 | As an isomer | 5.611 g |
| P-851403528 | N/A | As an isomer | by synthesis |
| P-881102439 | 98 | As an isomer | 30 mg |
| P-865904491 | 99 | As an isomer | 750 mg |
| P-904974781 | 95 | As an isomer | by synthesis |
| P-901462779 | 95 | As an isomer | by synthesis |
| P-892268843 | 95 | As an isomer | by synthesis |
| P-904252360 | 95 | As an isomer | unavailable |
| P-892347686 | 95 | As an isomer | 142 mg |
| P-855344689 | 90 | As an isomer | in stock |
| P-893999280 | 95 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 421.459 |
| logP | 4.5181 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 8 |
| PSA | 90.65 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 117.8244 |
| Atoms | 55 |
| Rings | 4 |
| Heavy atoms | 31 |
| Hydrogen atoms | 24 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
