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Amb22264895

Duplicate ID
CAS Number 353245-38-2
Molecule Name 4,6-Dioxo-9-(trifluoromethyl)-2,4,5,6-tetrahydro-1H-benzo[g]imidazo[1,2,3-ij]pteridin-12-ium chloride
4,6-Dioxo-9-(trifluoromethyl)-2,4,5,6-tetrahydro-1H-benzo[g]imidazo[1,2,3-ij]pteridin-12-ium chloride
10,12-dioxo-5-(trifluoromethyl)-1lambda5,8,11,13-tetraazatetracyclo[7.6.1.0^{2,7}.0^{13,16}]hexadeca-1(16),2,4,6,8-pentaen-1-ylium chloride
Smiles[Cl-].O=C1NC(=O)c2[n]c3cc(ccc3[n+]3CCN1c32)C(F)(F)F
InchiKeyQCVXRRWTLYFMPS-UHFFFAOYSA-N
InChi InChI=1S/C13H7F3N4O2.ClH/c14-13(15,16)6-1-2-8-7(5-6)17-9-10(21)18-12(22)20-4-3-19(8)11(9)20;/h1-2,5H,3-4H2;1H
Formula C13H8ClF3N4O2
Molecular weight 344.676
Rings 4
logP -2.4381
PSA 71.63
MR 77.7237
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