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MCULE-9454072097
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 | 42 USD | 95 | 7 working days | Get Quote |
| 5 mg | 99 USD | 95 | 7 working days | Get Quote |
| 10 mg | 179 USD | 95 | 7 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9454072097.sdf |
| SMILES | MCULE-9454072097.smiles |
| Standard InChI | MCULE-9454072097.inchi |
| InChIKey | MCULE-9454072097.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867687248 | N/A | As is | in stock |
| P-875865255 | N/A | As is | in stock |
| P-874651000 | 98 | As is | by resynthesis (? - ? days) |
| P-903326401 | 98 | As is | 75 mg |
| P-1264053384 | 95 | As is | in stock |
| P-893588879 | 90 | As is | 1.332 g |
| P-901181331 | N/A | As is | in stock |
| P-619134387 | 98 | As is | 500 mg |
| P-1273450877 | 95 | As is | by resynthesis (? - ? days) |
| P-864200448 | 95 | As is | in stock |
| P-901924734 | 98 | As is | 54 mg |
| P-901475199 | 95 | As is | by synthesis |
| P-871212242 | 95 | As is | by synthesis |
| P-901408913 | 98 | As is | 500 mg |
| P-855916097 | 97 | As is | 100 mg |
| P-854713444 | 95 | As is | in stock |
| P-871070630 | 95 | As is | in stock |
| P-892299694 | 95 | As is | unavailable |
| P-869163499 | 95 | As is | 150 mg |
| P-888658850 | 95 | As is | 148 mg |
| P-855299677 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 411.455 |
| logP | 3.8095 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 80.95 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 122.9164 |
| Atoms | 52 |
| Rings | 5 |
| Heavy atoms | 31 |
| Hydrogen atoms | 21 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
