CID 60149

Sertindole

Structural Information

Molecular Formula
C24H26ClFN4O
SMILES
C1CN(CCC1C2=CN(C3=C2C=C(C=C3)Cl)C4=CC=C(C=C4)F)CCN5CCNC5=O
InChI
InChI=1S/C24H26ClFN4O/c25-18-1-6-23-21(15-18)22(16-30(23)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
InChIKey
GZKLJWGUPQBVJQ-UHFFFAOYSA-N
Compound name
1-[2-[4-[5-chloro-1-(4-fluorophenyl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

452
References

13139
Patents

440.17792 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 441.18520 208.0
[M+Na]+ 463.16714 215.4
[M-H]- 439.17064 213.4
[M+NH4]+ 458.21174 216.1
[M+K]+ 479.14108 205.4
[M+H-H2O]+ 423.17518 194.8
[M+HCOO]- 485.17612 214.6
[M+CH3COO]- 499.19177 214.4
[M+Na-2H]- 461.15259 201.4
[M]+ 440.17737 204.4
[M]- 440.17847 204.4
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.