MCULE-3981723537
- 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.
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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.
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1 mg | 52 USD | 95 | 14 working days | Get Quote |
5 mg | 108 USD | 95 | 13 working days | Get Quote |
10 mg | 171 USD | 95 | 13 working days | Get Quote |
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Name | File |
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SDF | MCULE-3981723537.sdf |
SMILES | MCULE-3981723537.smiles |
Standard InChI | MCULE-3981723537.inchi |
InChIKey | MCULE-3981723537.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-500414633 | AvaChem Scientific | All products | 95 | As is | by synthesis |
P-871222096 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
P-881633887 | Chemfaces | Natural Compounds | 98 | As is | in stock |
P-851241003 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-579476613 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
P-505626720 | Endotherm | Endotherm General Catalog | 95 | As is | in stock |
P-579616259 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
P-852520065 | Matrix Scientific | All | N/A | As is | in stock |
P-854694092 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
P-872669739 | MedKoo | In stock compounds | 95 | As is | in stock |
P-498639342 | SV CHEMBIOTECH | SV Chembiotech Products | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 416.635 |
logP | 5.7047 |
H-bond acceptors | 3 |
H-bond donors | 3 |
Rotatable bonds | 6 |
PSA | 60.69 |
RO5 violations | 1 |
RO3 violations | 4 |
Refractivity | 127.4024 |
Atoms | 74 |
Rings | 3 |
Heavy atoms | 30 |
Hydrogen atoms | 44 |
Heteroatoms | 3 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 6 |
R/S chiral centers | 6 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 2 |
Cis/trans stereo double bonds | 2 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |