CID 489149

5-bromo-n-[(e)-(2-oxoindolin-3-ylidene)amino]-3-phenyl-1h-indole-2-carboxamide

Structural Information

Molecular Formula
C23H15BrN4O2
SMILES
C1=CC=C(C=C1)C2=C(NC3=C2C=C(C=C3)Br)C(=O)N=NC4=C(NC5=CC=CC=C54)O
InChI
InChI=1S/C23H15BrN4O2/c24-14-10-11-18-16(12-14)19(13-6-2-1-3-7-13)21(25-18)23(30)28-27-20-15-8-4-5-9-17(15)26-22(20)29/h1-12,25-26,29H
InChIKey
IRCKVPFCXQLGQD-UHFFFAOYSA-N
Compound name
5-bromo-N-[(2-hydroxy-1H-indol-3-yl)imino]-3-phenyl-1H-indole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

458.03784 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 459.04512 199.3
[M+Na]+ 481.02706 211.2
[M-H]- 457.03056 211.2
[M+NH4]+ 476.07166 213.3
[M+K]+ 497.00100 197.6
[M+H-H2O]+ 441.03510 196.6
[M+HCOO]- 503.03604 220.6
[M+CH3COO]- 517.05169 211.0
[M+Na-2H]- 479.01251 203.8
[M]+ 458.03729 219.5
[M]- 458.03839 219.5
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.