CID 24208912

853310-85-7

Structural Information

Molecular Formula
C19H21N3OS
SMILES
C1COCCN1CCNC2=CC(=NC3=CC=CC=C32)C4=CC=CS4
InChI
InChI=1S/C19H21N3OS/c1-2-5-16-15(4-1)17(14-18(21-16)19-6-3-13-24-19)20-7-8-22-9-11-23-12-10-22/h1-6,13-14H,7-12H2,(H,20,21)
InChIKey
TYDCGMVYWOVWIU-UHFFFAOYSA-N
Compound name
N-(2-morpholin-4-ylethyl)-2-thiophen-2-ylquinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.14053 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.14781 176.7
[M+Na]+ 362.12975 191.3
[M+NH4]+ 357.17435 186.1
[M+K]+ 378.10369 182.2
[M-H]- 338.13325 185.0
[M+Na-2H]- 360.11520 185.8
[M]+ 339.13998 181.7
[M]- 339.14108 181.7
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.