CID 3053779

Urea, 1-(3,4-dihydro-4-oxo-3-quinazolinylmethyl)-3-morpholinoacetyl-, tetrahydrochloride

Structural Information

Molecular Formula
C16H19N5O4
SMILES
C1COCCN1CC(=O)NC(=O)NCN2C=NC3=CC=CC=C3C2=O
InChI
InChI=1S/C16H19N5O4/c22-14(9-20-5-7-25-8-6-20)19-16(24)18-11-21-10-17-13-4-2-1-3-12(13)15(21)23/h1-4,10H,5-9,11H2,(H2,18,19,22,24)
InChIKey
XQXXQVJGLACAAY-UHFFFAOYSA-N
Compound name
2-morpholin-4-yl-N-[(4-oxoquinazolin-3-yl)methylcarbamoyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.1437 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.15098 178.7
[M+Na]+ 368.13292 188.7
[M+NH4]+ 363.17752 182.9
[M+K]+ 384.10686 184.5
[M-H]- 344.13642 181.5
[M+Na-2H]- 366.11837 182.8
[M]+ 345.14315 180.3
[M]- 345.14425 180.3
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.