CID 4663033

6-amino-1-isopropyl-7-methyl-4-phenylquinazolin-2(1h)-one

Structural Information

Molecular Formula
C18H19N3O
SMILES
CC1=CC2=C(C=C1N)C(=NC(=O)N2C(C)C)C3=CC=CC=C3
InChI
InChI=1S/C18H19N3O/c1-11(2)21-16-9-12(3)15(19)10-14(16)17(20-18(21)22)13-7-5-4-6-8-13/h4-11H,19H2,1-3H3
InChIKey
IJKRCDLJZQBETB-UHFFFAOYSA-N
Compound name
6-amino-7-methyl-4-phenyl-1-propan-2-ylquinazolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.1528 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.16008 170.2
[M+Na]+ 316.14202 186.4
[M+NH4]+ 311.18662 178.2
[M+K]+ 332.11596 178.4
[M-H]- 292.14552 175.2
[M+Na-2H]- 314.12747 178.5
[M]+ 293.15225 174.0
[M]- 293.15335 174.0
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.