MCULE-6702604595
- 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 | 36 USD | 90 | 19 working days | Get Quote |
5 mg | 52 USD | 90 | 19 working days | Get Quote |
10 mg | 66 USD | 90 | 19 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-6702604595.sdf |
SMILES | MCULE-6702604595.smiles |
Standard InChI | MCULE-6702604595.inchi |
InChIKey | MCULE-6702604595.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-348670 | Chemical Block | Screening Library | 90 | As is | 437 mg |
P-885949298 | A2B Chem | Predominantly Building Block on demand | N/A | As an isomer | by synthesis |
P-894621477 | AK Scientific | Building Blocks | 95 | As an isomer | in stock |
P-851597206 | AmBeed | On request | N/A | As an isomer | by synthesis |
P-15156315 | ChemDiv | Discovery Chemistry Library | 90 | As an isomer | 19 mg |
P-34731857 | Crea-Chim | HTS compounds | 90 | As an isomer | unavailable |
P-503145696 | Innovapharm | Virtual Screening Compounds | 90 | As an isomer | by synthesis |
P-492219645 | Innovapharm | Building Blocks | 95 | As an isomer | in stock |
P-14418298 | Life Chemicals | Screening Compounds | 90 | As an isomer | 57 mg |
P-12883340 | Otava | In-House Stock Library | 90 | As an isomer | 1.616 g |
P-492283996 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As an isomer | 1.616 g |
P-620105517 | Otava | In-House Stock Library | 90 | As an isomer | 110 mg |
P-424810398 | Princeton Biomolecular Research | Screening Compounds | 90 | As an isomer | in stock |
P-33444611 | TimTec | ActiMol 3 Week | 90 | As an isomer | in stock |
P-502338844 | TimTec | Building Block Collection | 90 | As an isomer | in stock |
P-855238222 | Toronto Research | In stock | 90 | As an isomer | in stock |
P-2375917 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As an isomer | 210 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 307.124 |
logP | 4.3152 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 46.53 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 77.8625 |
Atoms | 28 |
Rings | 3 |
Heavy atoms | 20 |
Hydrogen atoms | 8 |
Heteroatoms | 5 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
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 |