WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 524144
CAS#: 486414-32-8 (HCl)
Description: AG-012986 is a multitargeted cyclin-dependent kinase (CDK) inhibitor active against CDK1, CDK2, CDK4/6, CDK5, and CDK9, with selectivity over a diverse panel of non-CDK kinases. AG-012986 showed antiproliferative activities in vitro with IC(50)s of <100 nmol/L in 14 of 18 tumor cell lines. In vivo, significant antitumor efficacy induced by AG-012986 was seen (tumor growth inhibition, >83.1%) in 10 of 11 human xenograft tumor models. AG-012986 also showed dose-dependent retinoblastoma Ser(795) hypophosphorylation, cell cycle arrest, decreased Ki-67 tumor staining, and apoptosis in conjunction with antitumor activity. Note: many vendors confused the structure of AG-12286 (CAT#573461, CAS# 223784-75-6) with AG-012986 (CAT#406184, CAS# is 486414-35-1).
MedKoo Cat#: 524144
Name: AG-012986 HCl
CAS#: 486414-32-8 (HCl)
Chemical Formula: C22H25Cl2F2N5O2S
Exact Mass: 459.15405
Molecular Weight: 532.43
Elemental Analysis: C, 49.63; H, 4.73; Cl, 13.32; F, 7.14; N, 13.15; O, 6.01; S, 6.02
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Synonym: AG-012986 HCl; AG-012986 hydrochloride; AG-012986; AG 012986; AG012986; AG-12986; AG 12986; AG12986;
IUPAC/Chemical Name: 4-((4-Amino-5-(2,6-difluorobenzoyl)thiazol-2-yl)amino)-N-((R)-2-dimethylamino-1-methylethyl)benzamide dihydrochloride
InChi Key: MCUINVYSCWLFGD-CURYUGHLSA-N
InChi Code: InChI=1S/C22H23F2N5O2S.2ClH/c1-12(11-29(2)3)26-21(31)13-7-9-14(10-8-13)27-22-28-20(25)19(32-22)18(30)17-15(23)5-4-6-16(17)24;;/h4-10,12H,11,25H2,1-3H3,(H,26,31)(H,27,28);2*1H/t12-;;/m1../s1
SMILES Code: O=C(N[C@H](C)CN(C)C)C1=CC=C(NC2=NC(N)=C(C(C3=C(F)C=CC=C3F)=O)S2)C=C1.[H]Cl.[H]Cl
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: Soluble in DMSO, not in water
Shelf Life: >2 years if stored properly
Drug Formulation: This drug may be formulated in DMSO
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 532.43 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|