WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 465216
Description: IACS-70465 is a Potent IDO1 Inhibitor Targeting Indoleamine 2,3-Dioxygenase 1 (IDO1) Apoenzyme. IACS-70465 has excellent cellular potency, a robust pharmacodynamic response, and in a human whole blood assay was more potent than linrodostat (BMS-986205)
MedKoo Cat#: 465216
Chemical Formula: C24H22ClFN2O2
Exact Mass: 424.1354
Molecular Weight: 424.9004
Elemental Analysis: C, 67.84; H, 5.22; Cl, 8.34; F, 4.47; N, 6.59; O, 7.53
This product is not in stock, which may be available by custom synthesis.
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Synonym: IACS-70465; IACS70465; IACS 70465;
IUPAC/Chemical Name: (R)-N-(4-chlorophenyl)-2-((1R,3S,5S,6r)-3-((6-fluoroquinolin-4-yl)oxy)bicyclo[3.1.0]hexan-6-yl)propanamide
InChi Key: PGERJQKPSKSGLZ-URMHBIRVSA-N
InChi Code: InChI=1S/C24H22ClFN2O2/c1-13(24(29)28-16-5-2-14(25)3-6-16)23-18-11-17(12-19(18)23)30-22-8-9-27-21-7-4-15(26)10-20(21)22/h2-10,13,17-19,23H,11-12H2,1H3,(H,28,29)/t13-,17-,18-,19+,23+/m1/s1
SMILES Code: C[C@H]([C@@H]1[C@@]2([H])C[C@H](OC3=CC=NC4=CC=C(F)C=C34)C[C@@]12[H])C(NC5=CC=C(Cl)C=C5)=O
Appearance: Solid powder
Purity: >98% (or refer to the Certificate of Analysis)
Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility: To be determined
Shelf Life: >2 years if stored properly
Drug Formulation: To be determined
Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code: 2934.99.9001
The following data is based on the product molecular weight 424.9004 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.
|Concentration / Solvent Volume / Mass||1 mg||5 mg||10 mg|
|1 mM||1.15 mL||5.76 mL||11.51 mL|
|5 mM||0.23 mL||1.15 mL||2.3 mL|
|10 mM||0.12 mL||0.58 mL||1.15 mL|
|50 mM||0.02 mL||0.12 mL||0.23 mL|
1: Hamilton MM, Mseeh F, McAfoos TJ, Leonard PG, Reyna NJ, Harris AL, Xu A, Han M, Soth MJ, Czako B, Theroff JP, Mandal PK, Burke JP, Virgin-Downey B, Petrocchi A, Pfaffinger D, Rogers NE, Parker CA, Yu SS, Jiang Y, Krapp S, Lammens A, Trevitt G, Tremblay MR, Mikule K, Wilcoxen K, Cross JB, Jones P, Marszalek JR, Lewis RT. Discovery of IACS-9779 and IACS-70465 as Potent Inhibitors Targeting Indoleamine 2,3-Dioxygenase 1 (IDO1) Apoenzyme. J Med Chem. 2021 Jul 22. doi: 10.1021/acs.jmedchem.1c00679. Epub ahead of print. PMID: 34292726.