MCULE-3142042333-0
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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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 | 37 USD | 95 | 27 working days | Get Quote |
5 mg | 37 USD | 95 | 27 working days | Get Quote |
10 mg | 37 USD | 95 | 27 working days | Get Quote |
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MCULE-3168532179-0
- Component type: Main
Name | File |
---|---|
SDF | MCULE-3142042333-0.sdf |
SMILES | MCULE-3142042333-0.smiles |
Standard InChI | MCULE-3142042333-0.inchi |
InChIKey | MCULE-3142042333-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-854715224 | MedChemExpress | Screening compounds In stock | 95 | As a main component | in stock |
P-852195187 | A2B Chem | Predominantly Building Block on demand | N/A | As an isomer | by synthesis |
P-617552280 | AvaChem Scientific | All products | 95 | As an isomer | by synthesis |
P-861276071 | Chiralstar | Chiralstar Building Blocks | 95 | As an isomer | in stock |
P-869126620 | TargetMol | Screening Compounds - synthesis | 95 | As an isomer | by synthesis |
P-888639956 | TargetMol | Screening Compounds - stock amount | 95 | As an isomer | unavailable |
P-611529808 | Toronto Research | In stock | 90 | As an isomer | in stock |
P-855010208 | Toronto Research | In stock | 90 | As an isomer | in stock |
P-855010203 | Toronto Research | In stock | 90 | As an isomer | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 434.519 |
logP | 4.4775 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 6 |
PSA | 52.01 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 121.2708 |
Atoms | 55 |
Rings | 4 |
Heavy atoms | 30 |
Hydrogen atoms | 25 |
Heteroatoms | 7 |
N/O atoms | 3 |
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 | 1 |
Cis/trans stereo double bonds | 1 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |