CID 3041701

54743-06-5

Structural Information

Molecular Formula
C20H23ClN4O2
SMILES
CC(CN1C(=O)C(NC1=O)(C2=CC=C(C=C2)Cl)C3=CN=CC=C3)CN(C)C
InChI
InChI=1S/C20H23ClN4O2/c1-14(12-24(2)3)13-25-18(26)20(23-19(25)27,16-5-4-10-22-11-16)15-6-8-17(21)9-7-15/h4-11,14H,12-13H2,1-3H3,(H,23,27)
InChIKey
MAEDEZPBEDNHGA-UHFFFAOYSA-N
Compound name
5-(4-chlorophenyl)-3-[3-(dimethylamino)-2-methylpropyl]-5-pyridin-3-ylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

386.15094 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.158216 190.4
[M+Na]+ 409.140158 197.7
[M-H]- 385.143664 196.3
[M+NH4]+ 404.184763 202.0
[M+K]+ 425.114098 191.7
[M+H-H2O]+ 369.148200 180.4
[M+HCOO]- 431.149141 203.3
[M+CH3COO]- 445.164791 221.3
[M+Na-2H]- 407.125606 189.4
[M]+ 386.15039142 192.1
[M]- 386.15148858 192.1
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.