GRI918013

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

MedKoo CAT#: 530499

CAS#: 313685-55-1

Description: GRI918013 is a ATX inhibitor. Autotaxin (ATX) inhibitors represent an emerging class of drug candidates with therapeutic potential in the treatment of disease conditions that include cancer, cardiovascular disease, chronic inflammation, and neuropathic pain.

Chemical Structure

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GRI918013
CAS# 313685-55-1
Instruction

Theoretical Analysis

MedKoo Cat#: 530499
Name: GRI918013
CAS#: 313685-55-1
Chemical Formula: C17H15Cl2FN2O4S
Exact Mass: 432.01
Molecular Weight: 433.275
Elemental Analysis: C, 47.13; H, 3.49; Cl, 16.36; F, 4.38; N, 6.47; O, 14.77; S, 7.40

Price and Availability

This product is not in stock, which may be available by custom synthesis. For cost-effective reason, minimum order is 1g (price is usually high, lead time is 2~3 months, depending on the technical challenge). Quote less than 1g will not be provided. To request quote, please email to sales @medkoo.com or click below button.
Note: Price will be listed if it is available in the future.

Request quote for custom synthesis

Synonym: GRI918013; GRI-918013; GRI 918013.

IUPAC/Chemical Name: 2,4-dichloro-N-(3-fluorophenyl)-5-(morpholinosulfonyl)benzamide

InChi Key: WFSFEJJQFJYRFU-UHFFFAOYSA-N

InChi Code: InChI=1S/C17H15Cl2FN2O4S/c18-14-10-15(19)16(27(24,25)22-4-6-26-7-5-22)9-13(14)17(23)21-12-3-1-2-11(20)8-12/h1-3,8-10H,4-7H2,(H,21,23)

SMILES Code: O=C(NC1=CC=CC(F)=C1)C2=CC(S(=O)(N3CCOCC3)=O)=C(Cl)C=C2Cl

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: Modulation of autotaxin (ATX), the lysophospholipase D enzyme that produces lysophosphatidic acid, with small-molecule inhibitors is a promising strategy for blocking the ATX-lysophosphatidic acid signaling axis.

Biological target:
In vitro activity:
In vivo activity:

Preparing Stock Solutions

The following data is based on the product molecular weight 433.28 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
Formulation protocol:
In vitro protocol:
In vivo protocol:

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1. Fells, James I.; Lee, Sue Chin; Norman, Derek D.; Tsukahara, Ryoko; Kirby, Jason R.; Nelson, Sandra; Seibel, William; Papoian, Ruben; Patil, Renukadevi; Miller, Duane D.; et al. Targeting the hydrophobic pocket of autotaxin with virtual screening of inhibitors identifies a common aromatic sulfonamide structural motif. FEBS Journal (2014), 281(4), 1017-1028.

2. Fells, James I.; Lee, Sue Chin; Fujiwara, Yuko; Norman, Derek D.; Lim, Keng Gat; Tsukahara, Ryoko; Liu, Jianxiong; Patil, Renukadevi; Miller, Duane D.; Kirby, R. Jason; et al. Hits of a high-​throughput screen identify the hydrophobic pocket of autotaxin​/lysophospholipase D as an inhibitory surface. Molecular Pharmacology (2013), 84(3), 415-424.