MCULE-1530359404
- 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 | 7 USD | 97 | 14 working days | Get Quote |
| 5 mg | 7 USD | 97 | 14 working days | Get Quote |
| 10 mg | 7 USD | 97 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1530359404.sdf |
| SMILES | MCULE-1530359404.smiles |
| Standard InChI | MCULE-1530359404.inchi |
| InChIKey | MCULE-1530359404.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867579283 | 97 | As is | in stock |
| P-875739375 | 97 | As is | in stock |
| P-1275152452 | 95 | As is | in stock |
| P-1275176817 | 98 | As is | in stock |
| P-903069124 | 97 | As is | 200 g |
| P-1272347187 | 98 | As is | in stock |
| P-905477009 | 97 | As is | 100 g |
| P-1270401910 | 95 | As is | in stock |
| P-580200074 | 95 | As is | 2.875 g |
| P-606894823 | N/A | As is | in stock |
| P-881648835 | 85 | As is | 100 mg |
| P-596952251 | 97 | As is | 1000 g |
| P-1273451651 | 95 | As is | by resynthesis (? - ? days) |
| P-494336612 | 95 | As is | by resynthesis (? - ? days) |
| P-864127350 | 95 | As is | in stock |
| P-889740297 | 95 | As is | 24.5 g |
| P-860055273 | 98 | As is | by synthesis |
| P-580697216 | 95 | As is | 260 g |
| P-893231490 | 95 | As is | in stock |
| P-505572732 | 98 | As is | in stock |
| P-454718898 | 90 | As is | in stock |
| P-452657594 | 98 | As is | in stock |
| P-436460298 | 95 | As is | in stock |
| P-851272282 | 95 | As is | by synthesis |
| P-868576742 | 96 | As is | in stock |
| P-868661779 | 95 | As is | in stock |
| P-580302771 | 95 | As is | by resynthesis (? - ? days) |
| P-905338461 | 95 | As is | 250 g |
| P-889114480 | 95 | As is | 5.2 g |
| P-505492949 | 95 | As is | in stock |
| P-488544544 | 90 | As is | in stock |
| P-14014284 | 92 | As is | 300 mg |
| P-856009880 | 97 | As is | 100 mg |
| P-856042775 | 90 | As is | 2 g |
| P-31197635 | 90 | As is | 2 g |
| P-860794606 | N/A | As is | by synthesis |
| P-1272576580 | N/A | As is | 100 g |
| P-852431858 | N/A | As is | by synthesis |
| P-854690776 | 95 | As is | in stock |
| P-1263154804 | 95 | As is | by synthesis |
| P-619673471 | 98 | As is | in stock |
| P-454364984 | 92 | As is | in stock |
| P-500372222 | 98 | As is | by synthesis |
| P-885528487 | 95 | As is | by synthesis |
| P-19785227 | 90 | As is | in stock |
| P-617402639 | 98 | As is | in stock |
| P-869177794 | 95 | As is | in stock |
| P-892296218 | 95 | As is | unavailable |
| P-594274805 | 95 | As is | 11 mg |
| P-892338608 | 95 | As is | 11 mg |
| P-502366456 | 90 | As is | in stock |
| P-906776645 | 98 | As is | by synthesis |
| P-464681261 | 90 | As is | 1.613 g |
| P-35134034 | 90 | As is | 1.613 g |
| P-575312000 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 168.146 |
| logP | 1.099 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 66.76 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 41.9163 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 8 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |

