A 286982
Modify Date: 2025-09-06 17:46:33
A 286982 structure
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Common Name | A 286982 | ||
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| CAS Number | 280749-17-9 | Molecular Weight | 453.55400 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C24H27N3O4S | Melting Point | N/A | |
| MSDS | USA | Flash Point | N/A | |
Use of A 286982A-286982 is a potent and allosteric LFA-1/ICAM-1 interaction inhibitor with IC50s of 44 nM and 35 nM in an LFA-1/ICAM-1 binding and LFA-1-mediated cellular adhesion assay, respectively[1][2]. |
| Name | (E)-1-(4-acetylpiperazin-1-yl)-3-[3-nitro-4-(2-propan-2-ylphenyl)sulfanylphenyl]prop-2-en-1-one |
|---|---|
| Synonym | More Synonyms |
| Description | A-286982 is a potent and allosteric LFA-1/ICAM-1 interaction inhibitor with IC50s of 44 nM and 35 nM in an LFA-1/ICAM-1 binding and LFA-1-mediated cellular adhesion assay, respectively[1][2]. |
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| Related Catalog | |
| Target |
IC50: 44 nM (LFA-1/ICAM-1 interaction in an LFA-1/ICAM-1 binding assay) and 35 nM (LFA-1/ICAM-1 interaction in LFA-1-mediated cellular adhesion assay)[1] |
| In Vitro | A-286982 binds to the I domain allosteric site (IDAS). The allosteric ICAM inhibition such as this would be expected to exhibit the unsurmountable competition we have observed for A-286982 as a result of the passage of this allostery through the A-286982 binding site in its transmission from the β subunit I-like domain to the α subunit ICAM binding site[2]. |
| References |
| Molecular Formula | C24H27N3O4S |
|---|---|
| Molecular Weight | 453.55400 |
| Exact Mass | 453.17200 |
| PSA | 111.74000 |
| LogP | 4.97230 |
| InChIKey | HTGGAYLWTDOFDK-PKNBQFBNSA-N |
| SMILES | CC(=O)N1CCN(C(=O)C=Cc2ccc(Sc3ccccc3C(C)C)c([N+](=O)[O-])c2)CC1 |
| Storage condition | -20°C |
| RIDADR | NONH for all modes of transport |
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| unii-5i8wfs075a |