CID 3041699

Brn 0853302

Structural Information

Molecular Formula

C₂₁H₂₆N₄O₃

SMILES

CC(CN1C(=O)C(NC1=O)(C2=CC=C(C=C2)OC)C3=CN=CC=C3)CN(C)C

InChI

InChI=1S/C21H26N4O3/c1-15(13-24(2)3)14-25-19(26)21(23-20(25)27,17-6-5-11-22-12-17)16-7-9-18(28-4)10-8-16/h5-12,15H,13-14H2,1-4H3,(H,23,27)

InChIKey

IYUUGMSXPOMPPV-UHFFFAOYSA-N

Compound name

3-[3-(dimethylamino)-2-methylpropyl]-5-(4-methoxyphenyl)-5-pyridin-3-ylimidazolidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 382.2005 Da
Monoisotopic Mass: 2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	383.207776	191.2
[M+Na]+	405.189718	197.1
[M-H]-	381.193224	197.2
[M+NH4]+	400.234323	201.9
[M+K]+	421.163658	193.2
[M+H-H2O]+	365.197760	180.7
[M+HCOO]-	427.198701	208.5
[M+CH3COO]-	441.214351	222.9
[M+Na-2H]-	403.175166	190.4
[M]+	382.19995142	192.5
[M]-	382.20104858	192.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.