CTP Synthetase-IN-1

Name: CTP Synthetase-IN-1
Brand: MedChemExpress
SKU: HY-152149
Rating: 4.5 (1 reviews)

Cat. No.: HY-152149 Purity: 99.56%: FAQs
Data Sheet SDS COA Handling Instructions

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CTP Synthetase-IN-1 is a potent, orally active cytidine 5'-triphosphate synthetase (CTPS) inhibitor with IC₅₀s of 32 nM and 18 nM for human CTPS1 and human CTPS2, respectively. CTP Synthetase-IN-1 has anti-inflammatory effects.

For research use only. We do not sell to patients.

CTP Synthetase-IN-1 Chemical Structure

CAS No. : 2338811-71-3

Size	Price	Stock	Quantity
Solid + Solvent (Highly Recommended)
10 mM * 1 mL in DMSO ready for reconstitution	USD 209	In-stock	Estimated Time of Arrival: December 31
Solution
10 mM * 1 mL in DMSO	USD 209	In-stock	Estimated Time of Arrival: December 31
Solid
5 mg	USD 185	In-stock	Estimated Time of Arrival: December 31
10 mg	USD 310	In-stock	Estimated Time of Arrival: December 31
25 mg	USD 640	In-stock	Estimated Time of Arrival: December 31
50 mg	USD 1080	In-stock	Estimated Time of Arrival: December 31
100 mg	USD 1850	In-stock	Estimated Time of Arrival: December 31
200 mg		Get quote
500 mg		Get quote

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Customer Review

Based on 1 publication(s) in Google Scholar

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Biological Activity
Purity & Documentation
References
Customer Review

Description

IC₅₀ & Target

IC50: 32 nM (human CTPS1) and 18 nM (human CTPS2)^[1]

Cellular Effect

Cell Line	Type	Value	Description	References
Jurkat E6.1	IC₅₀	18 μM Compound: 27; T35	Antiproliferative activity against human Jurkat E6.1 cells after 3 days by luminescence based CellTiter-glo assay Antiproliferative activity against human Jurkat E6.1 cells after 3 days by luminescence based CellTiter-glo assay	[PMID: 36449304]

In Vitro

CTP Synthetase-IN-1 (compound 27) inhibits rat CTPS1, rat CTPS2, mouse CTPS1, and mouse CTPS2 with IC₅₀ values of 27 nM, 23 nM, 26 nM, and 33 nM, respectively^[1].

MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.

In Vivo

CTP Synthetase-IN-1 (compound 27; 10-50 mg/kg; p.o; twice daily; for 18 days) shows significant pharmacological responses in collagen-induced arthritis (CIA) model^[1].

MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.

Animal Model:	Mouse collagen-induced arthritis (CIA) model^[1]
Dosage:	10 mg/kg and 50 mg/kg
Administration:	p.o; twice daily; for 18 days
Result:	Resulted in improvements in specific indicators of disease severity.

Molecular Weight

512.53

Formula

C₂₀H₁₉F₃N₆O₃S₂

CAS No.

2338811-71-3

Appearance

Solid

Color

White to off-white

SMILES

O=C(C(C)(C)C1=CSC(NS(=O)(C2CC2)=O)=N1)NC3=NC=C(C4=NC(C(F)(F)F)=CN=C4)C=C3

Shipping

Room temperature in continental US; may vary elsewhere.

Storage

Powder	-20°C	3 years
	4°C	2 years
In solvent	-80°C	6 months
	-20°C	1 month

Solvent & Solubility

In Vitro:

DMSO : 100 mg/mL (195.11 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)

Preparing
Stock Solutions

Concentration Solvent Mass	1 mg	5 mg	10 mg

1 mM	1.9511 mL	9.7555 mL	19.5111 mL
5 mM	0.3902 mL	1.9511 mL	3.9022 mL
10 mM	0.1951 mL	0.9756 mL	1.9511 mL

View the Complete Stock Solution Preparation Table

* Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month. When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.

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Dilution Calculator

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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Volume _(start)

Concentration _(final)

Volume _(final)

In Vivo Dissolution Calculator

Please enter the basic information of animal experiments:

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mg/kg

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(per animal)

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(per animal)

μL

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Recommended: Prepare an additional quantity of animals to account for potential losses during experiments.

Calculation results:

Working solution concentration: mg/mL

Purity & Documentation

Purity: 99.56%

Select Batch:

Data Sheet (273 KB) SDS (251 KB)

COA (252 KB) HNMR (296 KB) LCMS (93 KB)

Handling Instructions (2659 KB)

References

[1]. Andrew Novak, et al. Discovery and Optimization of Potent and Orally Available CTP Synthetase Inhibitors for Use in Treatment of Diseases Driven by Aberrant Immune Cell Proliferation. J Med Chem. 2022 Dec 22;65(24):16640-16650. [Content Brief]

Complete Stock Solution Preparation Table

Optional Solvent	Concentration Solvent Mass	1 mg	5 mg	10 mg	25 mg

DMSO	1 mM	1.9511 mL	9.7555 mL	19.5111 mL	48.7776 mL
	5 mM	0.3902 mL	1.9511 mL	3.9022 mL	9.7555 mL
	10 mM	0.1951 mL	0.9756 mL	1.9511 mL	4.8778 mL
	15 mM	0.1301 mL	0.6504 mL	1.3007 mL	3.2518 mL
	20 mM	0.0976 mL	0.4878 mL	0.9756 mL	2.4389 mL
	25 mM	0.0780 mL	0.3902 mL	0.7804 mL	1.9511 mL
	30 mM	0.0650 mL	0.3252 mL	0.6504 mL	1.6259 mL
	40 mM	0.0488 mL	0.2439 mL	0.4878 mL	1.2194 mL
	50 mM	0.0390 mL	0.1951 mL	0.3902 mL	0.9756 mL
	60 mM	0.0325 mL	0.1626 mL	0.3252 mL	0.8130 mL
	80 mM	0.0244 mL	0.1219 mL	0.2439 mL	0.6097 mL
	100 mM	0.0195 mL	0.0976 mL	0.1951 mL	0.4878 mL