ChemicalBook--->CAS DataBase List--->15854-08-7

15854-08-7

15854-08-7 Structure

15854-08-7 Structure
IdentificationBack Directory
[Name]

ETHYL 2-AMINO-4-(4-METHYLPHENYL)-3-THIOPHENECARBOXYLATE
[CAS]

15854-08-7
[Synonyms]

AURORA 20241
AKOS MSC-0440
AKOS BBS-00000796
BUTTPARK 82\18-60
MFCD01827729,MFCD-01827729
Ethyl 2-amino-4-p-tolythiophene-3-carboxylate
ethyl 2-aMino-4-p-tolylthiophene-3-carboxylate
Ethyl 2-aMino-4-(p-tolyl)thiophene-3-carboxylate, 97+%
2-Amino-3-(ethoxycarbonyl)-4-(4-methylphenyl)thiophene
ETHYL 2-AMINO-4-(4-METHYLPHENYL)-3-THIOPHENECARBOXYLATE
ETHYL 2-AMINO-4-(4-METHYLPHENYL)THIOPHENE-3-CARBOXYLATE
2-AMINO-4-P-TOLYL-THIOPHENE-3-CARBOXYLIC ACID ETHYL ESTER
2-amino-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester
2-amino-4-(4-methylphenyl)thiophene-3-carboxylic acid ethyl ester
3-THIOPHENECARBOXYLIC ACID, 2-AMINO-4-(4-METHYLPHENYL)-, ETHYL ESTER
[Molecular Formula]

C14H15NO2S
[MDL Number]

MFCD01827729
[MOL File]

15854-08-7.mol
[Molecular Weight]

261.34
Chemical PropertiesBack Directory
[Melting point ]

105-107℃
[Boiling point ]

401.5±45.0 °C(Predicted)
[density ]

1.203±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C(protect from light)
[form ]

solid
[pka]

-0.04±0.14(Predicted)
[color ]

Off-white to light yellow
[InChI]

1S/C14H15NO2S/c1-3-17-14(16)12-11(8-18-13(12)15)10-6-4-9(2)5-7-10/h4-8H,3,15H2,1-2H3
[InChIKey]

GOQSMGNEJVWZIG-UHFFFAOYSA-N
[SMILES]

O=C(OCC)C1=C(N)SC=C1C(C=C2)=CC=C2C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P280a-P304+P340-P305+P351+P338-P405-P501a
[Hazard Codes ]

Xi
[Safety Statements ]

24/25
[WGK Germany ]

WGK 3
[HazardClass ]

IRRITANT
[Storage Class]

11 - Combustible Solids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Acetic acid-->Benzene-->Sulfur-->Ethyl cyanoacetate-->Diethylamine-->Ammonium acetate-->4'-Methylacetophenone
Hazard InformationBack Directory
[Uses]

aPKC-IN-2 is a small molecule inhibitor that inhibits aPKC activity. aPKC-IN-2 can effectively block vascular endothelial permeability in cell culture and in vivo experiments. aPKC-IN-2 shows biological activity in interfering with NFκB-driven gene transcription and is associated with inflammatory responses. aPKC-IN-2 has a significant inhibitory effect on vascular endothelial permeability induced by VEGF and TNF, and its EC50 value is in the low nanomolar range. The structural characteristics of aPKC-IN-2 reveal key elements of its inhibitory activity, providing the possibility for further development of small molecule aPKC inhibitors[1].
[References]

[1] Synthesis and structure-activity relationships of 2-amino-3-carboxy-4-phenylthiophenes as novel atypical protein kinase C inhibitors
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