CID 5277366

Benzyl n-(8-amino-3-methyl-2-phenyl-pyrido[2,3-b]pyrazin-6-yl)carbamate

Structural Information

Molecular Formula
C22H19N5O2
SMILES
CC1=C(N=C2C(=CC(=NC2=N1)NC(=O)OCC3=CC=CC=C3)N)C4=CC=CC=C4
InChI
InChI=1S/C22H19N5O2/c1-14-19(16-10-6-3-7-11-16)27-20-17(23)12-18(25-21(20)24-14)26-22(28)29-13-15-8-4-2-5-9-15/h2-12H,13H2,1H3,(H3,23,24,25,26,28)
InChIKey
JCTPTYUONGEXCI-UHFFFAOYSA-N
Compound name
benzyl N-(8-amino-3-methyl-2-phenylpyrido[2,3-b]pyrazin-6-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

385.15387 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.16115 193.5
[M+Na]+ 408.14309 200.9
[M-H]- 384.14659 199.9
[M+NH4]+ 403.18769 200.5
[M+K]+ 424.11703 193.9
[M+H-H2O]+ 368.15113 180.9
[M+HCOO]- 430.15207 212.8
[M+CH3COO]- 444.16772 201.9
[M+Na-2H]- 406.12854 199.5
[M]+ 385.15332 193.3
[M]- 385.15442 193.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.