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| Related CAS: | 1150565-89-1 (Z-isomer) |
| IUPAC Name: | 3-(4,5-dihydro-1,3-thiazol-2-yl)-N-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)-1,3-thiazolidin-2-imine |
| Description: | ERRα antagonist-1, a selective and high affinity antagonist of estrogen-related receptor α (ERRα), inhibits interaction of ERRα with Proliferator-activated Receptor γ Coactivator-1α (PGC-1α) and PGC-1β with IC50s of 170 and 180 nM, respectively. It does not inhibit the interaction of either ERRβ or ERRγ with PGC-1α and PGC-1β coactivator, and also does not inhibit interaction of ERα or ERβ with PGC-1α or SRC-1. |
| Molecular Weight: | 377.53 |
| Molecular Formula: | C21H19N3S2 |
| Canonical SMILES: | C1CSC(=N1)N2CCSC2=NC3C4=CC=CC=C4C=CC5=CC=CC=C35 |
| InChI: | InChI=1S/C21H19N3S2/c1-3-7-17-15(5-1)9-10-16-6-2-4-8-18(16)19(17)23-21-24(12-14-26-21)20-22-11-13-25-20/h1-10,19H,11-14H2 |
| InChI Key: | OWLQZFQCFCNPKV-UHFFFAOYSA-N |
| Boiling Point: | 579.0±60.0°C (Predicted) |
| Purity: | ≥95% |
| Density: | 1.36±0.1 g/cm3 (Predicted) |
| Solubility: | Soluble in DMSO |
| Storage: | Store at 2-8°C, protect from light |
| MDL: | MFCD17676143 |
| LogP: | 4.14090 |
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