MCULE-4858540073
- 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 | 39 USD | 98 | 16 working days | Get Quote |
5 mg | 39 USD | 98 | 16 working days | Get Quote |
10 mg | 39 USD | 98 | 16 working days | Get Quote |
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Name | File |
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SDF | MCULE-4858540073.sdf |
SMILES | MCULE-4858540073.smiles |
Standard InChI | MCULE-4858540073.inchi |
InChIKey | MCULE-4858540073.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-892939934 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-893267158 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-596562766 | Key Organics | Building Blocks | 97 | As is | 100 mg |
P-878649663 | Molnova | Stock | 98 | As is | in stock |
P-885549208 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 253.215 |
logP | -1.3246 |
H-bond acceptors | 9 |
H-bond donors | 5 |
Rotatable bonds | 3 |
PSA | 158.5 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 59.6208 |
Atoms | 29 |
Rings | 2 |
Heavy atoms | 18 |
Hydrogen atoms | 11 |
Heteroatoms | 9 |
N/O atoms | 9 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 2 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 2 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |