CID 489152

5-methyl-n-[(e)-[2-oxo-1-(1-piperidylmethyl)indolin-3-ylidene]amino]-3-phenyl-1h-indole-2-carboxamide

Structural Information

Molecular Formula
C30H29N5O2
SMILES
CC1=CC2=C(C=C1)NC(=C2C3=CC=CC=C3)C(=O)N=NC4=C(N(C5=CC=CC=C54)CN6CCCCC6)O
InChI
InChI=1S/C30H29N5O2/c1-20-14-15-24-23(18-20)26(21-10-4-2-5-11-21)28(31-24)29(36)33-32-27-22-12-6-7-13-25(22)35(30(27)37)19-34-16-8-3-9-17-34/h2,4-7,10-15,18,31,37H,3,8-9,16-17,19H2,1H3
InChIKey
VYCQCDBKEICHGH-UHFFFAOYSA-N
Compound name
N-[2-hydroxy-1-(piperidin-1-ylmethyl)indol-3-yl]imino-5-methyl-3-phenyl-1H-indole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

491.23212 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 492.23940 216.7
[M+Na]+ 514.22134 223.0
[M-H]- 490.22484 228.1
[M+NH4]+ 509.26594 224.0
[M+K]+ 530.19528 214.8
[M+H-H2O]+ 474.22938 204.4
[M+HCOO]- 536.23032 235.0
[M+CH3COO]- 550.24597 224.0
[M+Na-2H]- 512.20679 216.0
[M]+ 491.23157 216.8
[M]- 491.23267 216.8
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.