CID 208275

Thiazolo(4,5-d)pyrimidine-5,7(4h,6h)-dione, 4,6-dimethyl-2-(propylamino)-

Structural Information

Molecular Formula
C10H14N4O2S
SMILES
CCCNC1=NC2=C(S1)C(=O)N(C(=O)N2C)C
InChI
InChI=1S/C10H14N4O2S/c1-4-5-11-9-12-7-6(17-9)8(15)14(3)10(16)13(7)2/h4-5H2,1-3H3,(H,11,12)
InChIKey
BZRLXRYISRKEAJ-UHFFFAOYSA-N
Compound name
4,6-dimethyl-2-(propylamino)-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.08374 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.09102 153.7
[M+Na]+ 277.07296 167.5
[M-H]- 253.07646 156.3
[M+NH4]+ 272.11756 171.3
[M+K]+ 293.04690 162.9
[M+H-H2O]+ 237.08100 146.9
[M+HCOO]- 299.08194 172.6
[M+CH3COO]- 313.09759 196.8
[M+Na-2H]- 275.05841 156.6
[M]+ 254.08319 161.5
[M]- 254.08429 161.5
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

patents stripe