CID 477903

N-[4-(5-anilino-1,3,4-oxadiazol-2-yl)phenyl]-4-methoxy-benzamide

Structural Information

Molecular Formula
C22H18N4O3
SMILES
COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NN=C(O3)NC4=CC=CC=C4
InChI
InChI=1S/C22H18N4O3/c1-28-19-13-9-15(10-14-19)20(27)23-18-11-7-16(8-12-18)21-25-26-22(29-21)24-17-5-3-2-4-6-17/h2-14H,1H3,(H,23,27)(H,24,26)
InChIKey
SDFOXRBACPEZGH-UHFFFAOYSA-N
Compound name
N-[4-(5-anilino-1,3,4-oxadiazol-2-yl)phenyl]-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

386.13788 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.14516 190.0
[M+Na]+ 409.12710 196.1
[M-H]- 385.13060 201.2
[M+NH4]+ 404.17170 197.5
[M+K]+ 425.10104 191.8
[M+H-H2O]+ 369.13514 178.1
[M+HCOO]- 431.13608 213.0
[M+CH3COO]- 445.15173 199.7
[M+Na-2H]- 407.11255 194.4
[M]+ 386.13733 191.4
[M]- 386.13843 191.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.