MedKoo Cat#: 466232 | Name: aTAG 2139-NEG
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Description:

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

aTAG 2139-NEG is a negative control for aTAG 2139.

Chemical Structure

aTAG 2139-NEG
aTAG 2139-NEG
CAS#2758431-99-9 (NEG)

Theoretical Analysis

MedKoo Cat#: 466232

Name: aTAG 2139-NEG

CAS#: 2758431-99-9 (NEG)

Chemical Formula: C43H40N8O8

Exact Mass: 796.2969

Molecular Weight: 796.84

Elemental Analysis: C, 64.82; H, 5.06; N, 14.06; O, 16.06

Price and Availability

Size Price Availability Quantity
5mg USD 750.00 2 Weeks
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Synonym
aTAG 2139-NEG; aTAG-2139-NEG; aTAG-2139 NEG; aTAG 2139 -NEG; aTAG2139-NEG; aTAG2139 NEG;
IUPAC/Chemical Name
N-methyl-6-(6-((4-(2-((2-(1-methyl-2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)oxy)acetamido)butyl)carbamoyl)pyridin-3-yl)-4-(phenylamino)quinoline-3-carboxamide
InChi Key
COVBVFLLJYMIDR-UHFFFAOYSA-N
InChi Code
InChI=1S/C43H40N8O8/c1-44-39(54)30-23-48-31-15-13-25(21-29(31)38(30)49-27-9-4-3-5-10-27)26-14-16-32(47-22-26)40(55)46-20-7-6-19-45-35(52)24-59-34-12-8-11-28-37(34)43(58)51(41(28)56)33-17-18-36(53)50(2)42(33)57/h3-5,8-16,21-23,33H,6-7,17-20,24H2,1-2H3,(H,44,54)(H,45,52)(H,46,55)(H,48,49)
SMILES Code
CNC(C1=C(C2=CC(C3=CC=C(C(NCCCCNC(COC4=C(C5=CC=C4)C(N(C5=O)C6C(N(C(CC6)=O)C)=O)=O)=O)=O)N=C3)=CC=C2N=C1)NC7=CC=CC=C7)=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
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 796.84 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