CID 449284

173420-67-2

Structural Information

Molecular Formula
C24H24N4O
SMILES
C1CC1N=C(C2=CC=C(C=C2)C3=CC=C(O3)C4=CC=C(C=C4)C(=NC5CC5)N)N
InChI
InChI=1S/C24H24N4O/c25-23(27-19-9-10-19)17-5-1-15(2-6-17)21-13-14-22(29-21)16-3-7-18(8-4-16)24(26)28-20-11-12-20/h1-8,13-14,19-20H,9-12H2,(H2,25,27)(H2,26,28)
InChIKey
ZIZTVWLWYFAMPU-UHFFFAOYSA-N
Compound name
N'-cyclopropyl-4-[5-[4-(N'-cyclopropylcarbamimidoyl)phenyl]furan-2-yl]benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

3
Patents

384.195 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.20228 175.8
[M+Na]+ 407.18422 180.6
[M-H]- 383.18772 191.5
[M+NH4]+ 402.22882 177.3
[M+K]+ 423.15816 177.5
[M+H-H2O]+ 367.19226 169.3
[M+HCOO]- 429.19320 200.0
[M+CH3COO]- 443.20885 184.4
[M+Na-2H]- 405.16967 176.7
[M]+ 384.19445 178.0
[M]- 384.19555 178.0
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

No patent data available for this compound.