CID 3072890

Urea, n-(2,6-bis(1-methylethyl)phenyl)-n'-(2-(1h-indol-3-yl)ethyl)-

Structural Information

Molecular Formula
C23H29N3O
SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NCCC2=CNC3=CC=CC=C32
InChI
InChI=1S/C23H29N3O/c1-15(2)18-9-7-10-19(16(3)4)22(18)26-23(27)24-13-12-17-14-25-21-11-6-5-8-20(17)21/h5-11,14-16,25H,12-13H2,1-4H3,(H2,24,26,27)
InChIKey
FGIOFFUVGJJIRD-UHFFFAOYSA-N
Compound name
1-[2,6-di(propan-2-yl)phenyl]-3-[2-(1H-indol-3-yl)ethyl]urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

363.23105 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.23833 192.6
[M+Na]+ 386.22027 203.7
[M+NH4]+ 381.26487 199.3
[M+K]+ 402.19421 198.3
[M-H]- 362.22377 196.7
[M+Na-2H]- 384.20572 198.3
[M]+ 363.23050 195.1
[M]- 363.23160 195.1
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