MCULE-5913560343
- 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 | 89 USD | 90 | 17 working days | Get Quote |
5 mg | 110 USD | 90 | 17 working days | Get Quote |
10 mg | 707 USD | N/A | 26 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-5913560343.sdf |
SMILES | MCULE-5913560343.smiles |
Standard InChI | MCULE-5913560343.inchi |
InChIKey | MCULE-5913560343.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886112582 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-7728158 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2 mg |
P-14448861 | Life Chemicals | Screening Compounds | 90 | As is | 8 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 341.404 |
logP | 4.03 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 6 |
PSA | 72.22 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 94.4377 |
Atoms | 40 |
Rings | 3 |
Heavy atoms | 24 |
Hydrogen atoms | 16 |
Heteroatoms | 6 |
N/O atoms | 4 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |