structure of 6-amino-2,2-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

6-amino-2,2-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

CAS No.: 1002726-62-6
M. Wt: 193.202
M. Fa: C9H11N3O2
InChI Key: HSYOWUOUDXDSMC-UHFFFAOYSA-N
Appearance: Pale-yellow Solid

Names and Identifiers of 1002726-62-6

CAS Number

1002726-62-6

EC Number

691-593-0

MDL Number

MFCD10000812

IUPAC Name

6-amino-2,2-dimethyl-4H-pyrido[3,2-b][1,4]oxazin-3-one

InChI

InChI=1S/C9H11N3O2/c1-9(2)8(13)12-7-5(14-9)3-4-6(10)11-7/h3-4H,1-2H3,(H3,10,11,12,13)

InChIKey

HSYOWUOUDXDSMC-UHFFFAOYSA-N

Canonical SMILES

CC1(C(=O)NC2=C(O1)C=CC(=N2)N)C

UNII

49WR6Y8EVL

UNSPSC Code

12352100

Physical and chemical properties of 1002726-62-6

Acidity coefficient

10.79±0.40(Predicted)

Boiling Point

420.3±45.0 °C at 760 mmHg

Density

1.3±0.1 g/cm3

Exact Mass

193.085129

Flash Point

208.0±28.7 °C

Index of Refraction

1.571

LogP

1.25

Melting Point

280 to 290°C

Molecular Formula

C9H11N3O2

Molecular Weight

193.202

PSA

77.24000

Storage condition

2-8°C(protect from light)

Vapour Pressure

0.0±1.0 mmHg at 25°C

Safety Information of 1002726-62-6

Pictograms

Signal Word

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Interaction Studies of 1002726-62-6

Interaction studies involving 6-amino-2,2-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one focus on its mechanism as a Syk inhibitor. Research indicates that this compound effectively competes with ATP for binding to Syk, thereby inhibiting its activity and influencing downstream signaling pathways involved in immune responses.

Biological Activity of 1002726-62-6

6-amino-2,2-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one exhibits significant biological activity primarily due to its role as a competitive inhibitor of spleen tyrosine kinase (Syk). This inhibition is crucial in various signaling pathways associated with immune responses and inflammation. As part of Fostamatinib, it contributes to therapeutic effects in conditions like chronic immune thrombocytopenia by modulating immune cell activity.

Physical sample testing spectrum (NMR) of 1002726-62-6

Physical sample testing spectrum (NMR) of 1002726-62-6