CID 478034

Chembl2263584

Structural Information

Molecular Formula
C16H19ClN4O2
SMILES
C1COCCN1C2=CC(=NC3=C2C=CC(=N3)Cl)N4CCOCC4
InChI
InChI=1S/C16H19ClN4O2/c17-14-2-1-12-13(20-3-7-22-8-4-20)11-15(19-16(12)18-14)21-5-9-23-10-6-21/h1-2,11H,3-10H2
InChIKey
SRXHZWBWYXKFQE-UHFFFAOYSA-N
Compound name
4-(7-chloro-2-morpholin-4-yl-1,8-naphthyridin-4-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

334.11966 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.12694 180.2
[M+Na]+ 357.10888 185.9
[M-H]- 333.11238 184.4
[M+NH4]+ 352.15348 186.3
[M+K]+ 373.08282 182.0
[M+H-H2O]+ 317.11692 167.0
[M+HCOO]- 379.11786 184.2
[M+CH3COO]- 393.13351 187.6
[M+Na-2H]- 355.09433 183.6
[M]+ 334.11911 176.3
[M]- 334.12021 176.3
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.