MCULE-1943474930
- 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 | 20 USD | 95 | 19 working days | Get Quote |
5 mg | 20 USD | 95 | 19 working days | Get Quote |
10 mg | 20 USD | 95 | 19 working days | Get Quote |
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MCULE-4964310811
- Component type: Main
Name | File |
---|---|
SDF | MCULE-1943474930.sdf |
SMILES | MCULE-1943474930.smiles |
Standard InChI | MCULE-1943474930.inchi |
InChIKey | MCULE-1943474930.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-869317871 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
P-889420707 | FluoroChem | General BB | N/A | As a main component | in stock |
P-864069170 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 355.531 |
logP | 4.9295 |
H-bond acceptors | 4 |
H-bond donors | 0 |
Rotatable bonds | 19 |
PSA | 66.43 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 104.1755 |
Atoms | 64 |
Rings | 0 |
Heavy atoms | 25 |
Hydrogen atoms | 39 |
Heteroatoms | 4 |
N/O atoms | 4 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |