CID 1245862

N,n''-(4-methyl-1,3-phenylene)bis[n'-(4-methylphenyl)urea]

Structural Information

Molecular Formula
C23H24N4O2
SMILES
CC1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)C)NC(=O)NC3=CC=C(C=C3)C
InChI
InChI=1S/C23H24N4O2/c1-15-4-9-18(10-5-15)24-22(28)26-20-13-8-17(3)21(14-20)27-23(29)25-19-11-6-16(2)7-12-19/h4-14H,1-3H3,(H2,24,26,28)(H2,25,27,29)
InChIKey
ZPHINLJKDOIANS-UHFFFAOYSA-N
Compound name
1-[2-methyl-5-[(4-methylphenyl)carbamoylamino]phenyl]-3-(4-methylphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

388.1899 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.19718 198.4
[M+Na]+ 411.17912 210.2
[M+NH4]+ 406.22372 204.6
[M+K]+ 427.15306 202.5
[M-H]- 387.18262 206.3
[M+Na-2H]- 409.16457 207.5
[M]+ 388.18935 202.1
[M]- 388.19045 202.1
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

patents stripe