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Duplicate ID | |
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CAS Number | 114853-42-8 |
Molecule Name | 10,12-dioxo-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 |
4,6-Dioxo-2,4,5,6-tetrahydro-1H-benzo[g]imidazo[1,2,3-ij]pteridin-12-ium chloride | |
4,6-Dioxo-2,4,5,6-tetrahydro-1H-benzo[g]imidazo-[1,2,3-ij]pteridin-12-ium chloride | |
4,6-Dioxo-2,4,5,6-tetrahydro-1H-benzo[g]imidazo-[1,2,3-ij]pteridin-12-ium chloride | |
Smiles | [Cl-].O=C1NC(=O)c2[n]c3ccccc3[n+]3CCN1c32 |
InchiKey | UKQDCOMWRMLNKZ-UHFFFAOYSA-N |
InChi | InChI=1S/C12H8N4O2.ClH/c17-10-9-11-15(5-6-16(11)12(18)14-10)8-4-2-1-3-7(8)13-9;/h1-4H,5-6H2;1H |
Formula | C12H9ClN4O2 |
Molecular weight | 276.678 |
Rings | 4 |
logP | -3.4569 |
PSA | 71.63 |
MR | 72.7217 |