CID 3074815

Oxazolo(5,4-b)pyridin-2(1h)-one, 1-(4-(4-(4-fluorophenyl)-1-piperazinyl)butyl)-

Structural Information

Molecular Formula
C20H23FN4O2
SMILES
C1CN(CCN1CCCCN2C3=C(N=CC=C3)OC2=O)C4=CC=C(C=C4)F
InChI
InChI=1S/C20H23FN4O2/c21-16-5-7-17(8-6-16)24-14-12-23(13-15-24)10-1-2-11-25-18-4-3-9-22-19(18)27-20(25)26/h3-9H,1-2,10-15H2
InChIKey
NWWIANVERZWOLK-UHFFFAOYSA-N
Compound name
1-[4-[4-(4-fluorophenyl)piperazin-1-yl]butyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

370.1805 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.18778 190.3
[M+Na]+ 393.16972 204.9
[M+NH4]+ 388.21432 196.1
[M+K]+ 409.14366 198.7
[M-H]- 369.17322 194.2
[M+Na-2H]- 391.15517 196.6
[M]+ 370.17995 193.4
[M]- 370.18105 193.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.