Fluorine F 18 fluorthanatrace
2-[4-(2-(18F)fluoroethoxy)phenyl]-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-9-one
Molecular Identity
Fluorine F 18 fluorthanatrace
2-[4-(2-(18F)fluoroethoxy)phenyl]-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-9-one
PubChem CID: 76310432
2D Structure
Properties
C18H16FN3O2
Molecular Formula
324.30
Molecular Weight
g/mol
324.1252
Exact Mass
Da
2.4
XLogP
Drug-like (Lipinski: < 5)
56.2
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
4
H-Bond Acceptors
456
Complexity
SMILES
Canonical SMILES
SMILES: C1CN2C3=C(C=CC=C3N=C2C4=CC=C(C=C4)OCCF)C(=O)N1Isomeric SMILES
SMILES: C1CN2C3=C(C=CC=C3N=C2C4=CC=C(C=C4)OCC[18F])C(=O)N1Synonyms(13)
Fluorthanatrace F-18Fluorine F 18 fluorthanatrace9B8U3WZ84WUNII-9B8U3WZ84W1567375-87-41-(4-(2-Fluoroethoxy)phenyl)-8,9-dihydro-2,7,atriazabenzo(cd)azelen-6(7H)-one F-182-[4-(2-(18F)fluoranylethoxy)phenyl]-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-9-oneCHEMBL3113564(18F)-WC-4-1382-(4-(2-(FLUORO-18F)ETHOXY)PHENYL)-5,6-DIHYDROIMIDAZO(4,5,1-JK)(1,4)BENZODIAZEPIN-7(4H)-ONE2-{4-[2-((1)F)fluoroethoxy]phenyl}-1,3,10-triazatricyclo[6.4.1.0,(1)(3)]trideca-2,4,6,8(13)-tetraen-9-one2-{4-[2-()fluoroethoxy]phenyl}-1,3,10-triazatricyclo[6.4.1.0,]trideca-2,4,6,8(13)-tetraen-9-oneIMIDAZO(4,5,1-JK)(1,4)BENZODIAZEPIN-7(4H)-ONE, 2-(4-(2-(FLUORO-18F)ETHOXY)PHENYL)-5,6-DIHYDRO-
Data from PubChem (NCBI)
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