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MCULE-3875044539
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 | 72 USD | 95 | 10 working days | Get Quote |
| 5 mg | 89 USD | 95 | 10 working days | Get Quote |
| 10 mg | 104 USD | 95 | 42 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-3875044539.sdf |
| SMILES | MCULE-3875044539.smiles |
| Standard InChI | MCULE-3875044539.inchi |
| InChIKey | MCULE-3875044539.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886746559 | N/A | As is | in stock |
| P-890183830 | N/A | As is | in stock |
| P-893432602 | 90 | As is | by synthesis |
| P-895919920 | 95 | As is | by resynthesis (? - ? days) |
| P-869403729 | 95 | As is | by synthesis |
| P-887189883 | 95 | As is | by synthesis |
| P-870647155 | N/A | As is | in stock |
| P-870647298 | N/A | As is | in stock |
| P-454289024 | 95 | As is | 4.989 g |
| P-454323812 | 95 | As is | 3.058 g |
| P-454405258 | 95 | As is | 3.058 g |
| P-454386718 | 95 | As is | 4.989 g |
| P-31131085 | 90 | As is | unavailable |
| P-869092001 | 95 | As is | by synthesis |
| P-888896420 | N/A | As is | in stock |
| P-885541766 | 95 | As is | by synthesis |
| P-906775758 | 98 | As is | by synthesis |
| P-906770875 | 98 | As is | by synthesis |
| P-893965551 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 310.302 |
| logP | 3.0293 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 121.45 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 80.1645 |
| Atoms | 40 |
| Rings | 1 |
| Heavy atoms | 22 |
| Hydrogen atoms | 18 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
