MedKoo Cat#: 562289 | Name: 6H05 TFA
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Description:

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

6H05 TFA is a selective and allosteric inhibitor of oncogenic K-Ras(G12C) .

Chemical Structure

6H05 TFA
6H05 TFA
CAS#2061344-88-3 (TFA)

Theoretical Analysis

MedKoo Cat#: 562289

Name: 6H05 TFA

CAS#: 2061344-88-3 (TFA)

Chemical Formula: C22H31ClF3N3O4S3

Exact Mass: 0.0000

Molecular Weight: 590.13

Elemental Analysis: C, 44.78; H, 5.30; Cl, 6.01; F, 9.66; N, 7.12; O, 10.84; S, 16.30

Price and Availability

Size Price Availability Quantity
5mg USD 450.00 2 Weeks
10mg USD 750.00 2 Weeks
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Related CAS #
2061344-88-3 (TFA); 1469338-01-9 (free base)
Synonym
6H05 TFA; 6H05 TFA salt; 6-H-05 TFA; 6-H-05 TFA salt; 6 H 05 TFA; 6 H 05 TFA salt; K-Ras(G12C) inhibitor 6H05;
IUPAC/Chemical Name
1-[2-[(4-Chlorophenyl)thio]acetyl]-N-[2-[[2-(dimethylamino)ethyl]dithio]ethyl]-4-piperidinecarboxamide 2,2,2-trifluoroacetate
InChi Key
YNMYIJSFFJXIRV-UHFFFAOYSA-N
InChi Code
InChI=1S/C20H30ClN3O2S3.C2HF3O2/c1-23(2)12-14-29-28-13-9-22-20(26)16-7-10-24(11-8-16)19(25)15-27-18-5-3-17(21)4-6-18;3-2(4,5)1(6)7/h3-6,16H,7-15H2,1-2H3,(H,22,26);(H,6,7)
SMILES Code
O=C(C1CCN(C(CSC2=CC=C(Cl)C=C2)=O)CC1)NCCSSCCN(C)C.O=C(O)C(F)(F)F
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
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
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 590.13 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.

Recalculate based on batch purity %
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