MCULE-3457216442
- 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 | 119 USD | 95 | 22 working days | Get Quote |
5 mg | 119 USD | 95 | 22 working days | Get Quote |
10 mg | 119 USD | 95 | 22 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-3457216442.sdf |
SMILES | MCULE-3457216442.smiles |
Standard InChI | MCULE-3457216442.inchi |
InChIKey | MCULE-3457216442.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886670377 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-889973315 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-869336247 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-851395713 | AmBeed | On request | N/A | As is | by synthesis |
P-437467699 | AnalytiCon Discovery | Natural screening compounds (85%+) | 85 | As is | 1 mg |
P-889800648 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-611163617 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-611594173 | Toronto Research | In stock | 90 | As is | in stock |
P-893866339 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 201.263 |
logP | 1.6488 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 6 |
PSA | 66.4 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 54.9575 |
Atoms | 33 |
Rings | 0 |
Heavy atoms | 14 |
Hydrogen atoms | 19 |
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 |