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MCULE-4177442506
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 | 104 USD | 90 | 27 working days | Get Quote |
| 5 mg | 117 USD | 90 | 27 working days | Get Quote |
| 10 mg | 137 USD | 90 | 27 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-4177442506.sdf |
| SMILES | MCULE-4177442506.smiles |
| Standard InChI | MCULE-4177442506.inchi |
| InChIKey | MCULE-4177442506.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867406239 | 95 | As is | by synthesis |
| P-894653304 | 95 | As is | in stock |
| P-851892656 | N/A | As is | by synthesis |
| P-494454430 | 95 | As is | by resynthesis (? - ? days) |
| P-591064814 | 95 | As is | by synthesis |
| P-901428456 | 95 | As is | by synthesis |
| P-454759614 | 90 | As is | in stock |
| P-861367392 | 95 | As is | by synthesis |
| P-34572536 | 90 | As is | by synthesis |
| P-580779289 | 90 | As is | by resynthesis (? - ? days) |
| P-580768475 | 90 | As is | in stock |
| P-580487749 | N/A | As is | by synthesis |
| P-854860438 | 95 | As is | by synthesis |
| P-491132137 | 95 | As is | by synthesis |
| P-23882176 | 90 | As is | in stock |
| P-33467529 | 90 | As is | in stock |
| P-502344812 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 250.221 |
| logP | 1.7015 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 72.94 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 53.8086 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 17 |
| Hydrogen atoms | 13 |
| Heteroatoms | 8 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
