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MCULE-4168572580
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 | 23 USD | 98 | 16 working days | Get Quote |
| 5 mg | 23 USD | 98 | 16 working days | Get Quote |
| 10 mg | 33 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4168572580.sdf |
| SMILES | MCULE-4168572580.smiles |
| Standard InChI | MCULE-4168572580.inchi |
| InChIKey | MCULE-4168572580.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-597026512 | 95 | As is | unavailable |
| P-893502455 | 90 | As is | 40.75 g |
| P-900154906 | 95 | As is | in stock |
| P-871220406 | N/A | As is | by resynthesis (? - ? days) |
| P-505572628 | 98 | As is | in stock |
| P-851266878 | 95 | As is | by synthesis |
| P-868591864 | 98 | As is | in stock |
| P-579478358 | 95 | As is | in stock |
| P-861987214 | 98 | As is | 17.533 g |
| P-905338102 | 98 | As is | 1.5 g |
| P-852443747 | 95 | As is | by synthesis |
| P-896627465 | 95 | As is | by synthesis |
| P-474022431 | 95 | As is | in stock |
| P-608275306 | 98 | As is | in stock |
| P-1263956205 | 90 | As is | in stock |
| P-579709973 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 285.686 |
| logP | 0.2838 |
| H-bond acceptors | 8 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 119.31 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 66.522 |
| Atoms | 31 |
| Rings | 3 |
| Heavy atoms | 19 |
| Hydrogen atoms | 12 |
| Heteroatoms | 9 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
