CID 5401

Terazosin

Structural Information

Molecular Formula
C19H25N5O4
SMILES
COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4CCCO4)N)OC
InChI
InChI=1S/C19H25N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h10-11,14H,3-9H2,1-2H3,(H2,20,21,22)
InChIKey
VCKUSRYTPJJLNI-UHFFFAOYSA-N
Compound name
[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

909
References

28384
Patents

387.19064 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.19792 193.2
[M+Na]+ 410.17986 203.8
[M+NH4]+ 405.22446 197.9
[M+K]+ 426.15380 201.4
[M-H]- 386.18336 197.2
[M+Na-2H]- 408.16531 196.1
[M]+ 387.19009 195.4
[M]- 387.19119 195.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe