ChemicalBook >> CAS DataBase List >>2-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)-N-(4-ISOPROPYLPHENYL)ACETAMIDE

2-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)-N-(4-ISOPROPYLPHENYL)ACETAMIDE

CAS No.
349085-38-7
Chemical Name:
2-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)-N-(4-ISOPROPYLPHENYL)ACETAMIDE
Synonyms
CS-828;HC 030031;HC 030031 1G;TOSLAB 829227;HC030031; HC 030031;HC-030031 (TOSLAB-829227);TrpA1 Antagonist, HC-030031;HC-030031;HC 030031;HC030031;TrpA1 Antagonist, HC-030031 - CAS 349085-38-7 - Calbiochem;2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)aceta...
CBNumber:
CB6334374
Molecular Formula:
C18H21N5O3
Molecular Weight:
355.39
MDL Number:
MFCD02007349
MOL File:
349085-38-7.mol
MSDS File:
SDS
Last updated:2023-06-30 15:45:59

2-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)-N-(4-ISOPROPYLPHENYL)ACETAMIDE Properties

Melting point 221-223°C
Density 1.33±0.1 g/cm3(Predicted)
storage temp. room temp
solubility DMSO: soluble10mg/mL, clear
pka 13.71±0.70(Predicted)
form White solid
color white to beige
Stability Stable for 2 years from date of purchase as supplied. Solutions in DMSO may be stored at -20°C for up to 3 months.
InChIKey HEQDZPHDVAOBLN-UHFFFAOYSA-N
FDA UNII MU78VFH9C7

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS06
Signal word  Danger
Hazard statements  H301
Precautionary statements  P264-P270-P301+P310-P321-P330-P405-P501
Hazard Codes  T
Risk Statements  25
Safety Statements  45
RIDADR  UN 2811 6.1 / PGIII
WGK Germany  3
NFPA 704
0
2 0

2-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)-N-(4-ISOPROPYLPHENYL)ACETAMIDE price More Price(21)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich H4415 HC-030031 ≥98% (HPLC), powder 349085-38-7 10mg $150 2024-03-01 Buy
Sigma-Aldrich H4415 HC-030031 ≥98% (HPLC), powder 349085-38-7 50mg $589 2024-03-01 Buy
Cayman Chemical 11923 HC-030031 ≥98% 349085-38-7 5mg $28 2024-03-01 Buy
Cayman Chemical 11923 HC-030031 ≥98% 349085-38-7 10mg $48 2024-03-01 Buy
Cayman Chemical 11923 HC-030031 ≥98% 349085-38-7 50mg $140 2024-03-01 Buy
Product number Packaging Price Buy
H4415 10mg $150 Buy
H4415 50mg $589 Buy
11923 5mg $28 Buy
11923 10mg $48 Buy
11923 50mg $140 Buy

2-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)-N-(4-ISOPROPYLPHENYL)ACETAMIDE Chemical Properties,Uses,Production

Description

Transient receptor potential cation channel A1 (TRPA1) is an ankyrin-like ion channel which acts as a sensor for chemical irritants, pain, and cold. It is activated by allyl isothiocyanate (AITC), formalin, hydrogen peroxide, tear gas, and other compounds. HC-030031 is a selective TRPA1 blocker, antagonizing TRPA1-mediated calcium influx induced by AITC and formalin (IC50s = 6.2 and 5.3 μM, respectively). It does not block currents mediated by TRPV1, TRPV3, TRPV4 hERG, or NaV1.2 channels. HC-030031 can be used in cells or delivered to animals orally, by inhalation, or by injection. Oral administration (100 mg/kg) of HC-030031 significantly reversed mechanical hypersensitivity in rat models of chronic inflammatory or neuropathic pain, while local injection (100 μg) into inflamed mouse hind paws attenuated mechanical, but not heat, hypersensitivity.

Chemical Properties

White Solid

Uses

A TRPA1 (transient receptor potential) selective antagonist, attenuates inflammatory- and neuropathy-induced mechanical hypersensitivity.

Biological Activity

Selective TRPA1 channel blocker that antagonizes AITC- and formalin-evoked calcium influx (IC 50 values are 6.2 and 5.3 μ M respectively). Does not block currents mediated by TRPV1, TRPV3, TRPV4, hERG or Na V 1.2 channels. Inhibits AITC- and formalin-induced flinching in vivo .

Biochem/physiol Actions

HC-030031 is a selective TRPA1 channel blocker, antagonizing formalin-evoked calcium influx and formalin-induced pain. IC50 is 5 μM. TRPA1 antagonism is a promising therapeutic target for chronic inflammatory or neurogenic pain.

storage

Room temperature

References

1) McNamara et al. (2007), TRPA1 mediates formalin-induced pain; Proc. Natl. Acad. Sci., 104 13525

2-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)-N-(4-ISOPROPYLPHENYL)ACETAMIDE Preparation Products And Raw materials

Raw materials

Preparation Products

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2-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)-N-(4-ISOPROPYLPHENYL)ACETAMIDE Spectrum

2-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)-N-(4-ISOPROPYLPHENYL)ACETAMIDE HC 030031 2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N-(4-isopropylphenyl)acetamide 1,2,3,6-Tetrahydro-1,3-diMethyl-N-[4-(1-Methylethyl)phenyl]-2,6-dioxo-7H-purine-7-acetaMide 7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-1,3-dimethyl-N-[4-(1-methylethyl)phenyl]-2,6-dioxo- HC-030031;HC 030031;HC030031 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-propan-2-ylphenyl)acetamide HC 030031 1G TrpA1 Antagonist, HC-030031 TOSLAB 829227 2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6 -tetrahydro-purin-7-yl)-N-isoprop yl-phenyl)-acetamide TrpA1 Antagonist, HC-030031 - CAS 349085-38-7 - Calbiochem HC030031; HC 030031 CS-828 HC-030031 (TOSLAB-829227) 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)aceta... 349085-38-7 Intermediates & Fine Chemicals Pharmaceuticals Inhibitors Amines Aromatics Heterocycles