CID 13827169

6-(2-amino-1,3-thiazol-4-yl)-3-methyl-1,2,3,4-tetrahydroquinazolin-2-one

Structural Information

Molecular Formula
C12H12N4OS
SMILES
CN1CC2=C(C=CC(=C2)C3=CSC(=N3)N)NC1=O
InChI
InChI=1S/C12H12N4OS/c1-16-5-8-4-7(10-6-18-11(13)14-10)2-3-9(8)15-12(16)17/h2-4,6H,5H2,1H3,(H2,13,14)(H,15,17)
InChIKey
YECFCLHDNOLZIB-UHFFFAOYSA-N
Compound name
6-(2-amino-1,3-thiazol-4-yl)-3-methyl-1,4-dihydroquinazolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.07318 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.08046 156.7
[M+Na]+ 283.06240 168.9
[M+NH4]+ 278.10700 164.5
[M+K]+ 299.03634 162.7
[M-H]- 259.06590 159.4
[M+Na-2H]- 281.04785 161.8
[M]+ 260.07263 159.5
[M]- 260.07373 159.5
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.