IK-1-012 | CAS# | IDH1| MedKoo

MedKoo Cat#: 122431 | Name: IK-1-012

Description:

WARNING: This product is for research use only, not for human or veterinary use.

IK-1-012 is a IDH1 binding probe

Chemical Structure

IK-1-012

CAS#N/A

Theoretical Analysis

MedKoo Cat#: 122431

Name: IK-1-012

CAS#: N/A

Chemical Formula: C59H55F3N12O8S

Exact Mass: 1148.3939

Molecular Weight: 1149.22

Elemental Analysis: C, 61.66; H, 4.82; F, 4.96; N, 14.63; O, 11.14; S, 2.79

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.

Bulk Inquiry

Related CAS #

No Data

Synonym

IK-1-012; IK-1 012; IK-1012

IUPAC/Chemical Name

N-(4-(4-(3-((6-(3-(3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthen]-5-yl)thioureido)hexyl)amino)-3-oxopropyl)-1H-1,2,3-triazol-1-yl)phenyl)-7,7-dimethyl-5-(1H-pyrazole-4-carbonyl)-1-(4-(trifluoromethyl)benzyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide

InChi Key

RPBXEYGAZGFGQE-UHFFFAOYSA-N

InChi Code

InChI=1S/C59H55F3N12O8S/c1-57(2)33-72(54(79)35-28-65-66-29-35)32-44-51(70-74(52(44)57)30-34-7-9-36(10-8-34)59(60,61)62)53(78)67-37-11-15-40(16-12-37)73-31-39(69-71-73)14-22-50(77)63-23-5-3-4-6-24-64-56(83)68-38-13-19-45-43(25-38)55(80)82-58(45)46-20-17-41(75)26-48(46)81-49-27-42(76)18-21-47(49)58/h7-13,15-21,25-29,31,75-76H,3-6,14,22-24,30,32-33H2,1-2H3,(H,63,77)(H,65,66)(H,67,78)(H2,64,68,83)

SMILES Code

O=C(N1CC(C)(C)C(N(CC2=CC=C(C(F)(F)F)C=C2)N=C3C(NC4=CC=C(N5C=C(CCC(NCCCCCCNC(NC6=CC(C(OC78C(C=CC(O)=C9)=C9OC%10=C8C=CC(O)=C%10)=O)=C7C=C6)=S)=O)N=N5)C=C4)=O)=C3C1)C%11=CNN=C%11

Appearance

To be determined

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

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 1,149.22 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

Vaziri-Gohar, A., Cassel, J., Mohammed, F.S. et al. Limited nutrient availability in the tumor microenvironment renders pancreatic tumors sensitive to allosteric IDH1 inhibitors. Nat Cancer 3, 852–865 (2022). https://doi.org/10.1038/s43018-022-00393-y