CID 215379

Urea, n-(3-chlorophenyl)-n'-(4,5-diphenyl-2-oxazolyl)-

Structural Information

Molecular Formula
C22H16ClN3O2
SMILES
C1=CC=C(C=C1)C2=C(OC(=N2)NC(=O)NC3=CC(=CC=C3)Cl)C4=CC=CC=C4
InChI
InChI=1S/C22H16ClN3O2/c23-17-12-7-13-18(14-17)24-21(27)26-22-25-19(15-8-3-1-4-9-15)20(28-22)16-10-5-2-6-11-16/h1-14H,(H2,24,25,26,27)
InChIKey
SFQNSJDPYBEEOG-UHFFFAOYSA-N
Compound name
1-(3-chlorophenyl)-3-(4,5-diphenyl-1,3-oxazol-2-yl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

389.0931 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.10038 192.8
[M+Na]+ 412.08232 200.2
[M-H]- 388.08582 205.0
[M+NH4]+ 407.12692 202.7
[M+K]+ 428.05626 193.9
[M+H-H2O]+ 372.09036 182.4
[M+HCOO]- 434.09130 212.4
[M+CH3COO]- 448.10695 203.0
[M+Na-2H]- 410.06777 196.2
[M]+ 389.09255 195.0
[M]- 389.09365 195.0
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

patents stripe