CID 156442379

Stc-15

Structural Information

Molecular Formula
C24H25N5O2
SMILES
C1CC(C1)CNCC2=CC3=C(N2)C=C(C=C3)CNC(=O)C4=CC(=O)N5C=CC=CC5=N4
InChI
InChI=1S/C24H25N5O2/c30-23-12-21(28-22-6-1-2-9-29(22)23)24(31)26-14-17-7-8-18-11-19(27-20(18)10-17)15-25-13-16-4-3-5-16/h1-2,6-12,16,25,27H,3-5,13-15H2,(H,26,31)
InChIKey
MFQFZLWCFZZHAI-UHFFFAOYSA-N
Compound name
N-[[2-[(cyclobutylmethylamino)methyl]-1H-indol-6-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

16
Patents

415.20084 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 416.20812 198.9
[M+Na]+ 438.19006 203.6
[M-H]- 414.19356 204.6
[M+NH4]+ 433.23466 200.8
[M+K]+ 454.16400 199.5
[M+H-H2O]+ 398.19810 181.5
[M+HCOO]- 460.19904 215.4
[M+CH3COO]- 474.21469 205.7
[M+Na-2H]- 436.17551 201.9
[M]+ 415.20029 207.0
[M]- 415.20139 207.0
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.