1.0 2026-09-22 04:29:48 UTC 2026-09-22 04:29:48 UTC FDB117704 METRIBUZIN 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one C8H14N4OS 214.288 214.08883178 4-amino-6-tert-butyl-3-(methylsulfanyl)-4,5-dihydro-1,2,4-triazin-5-one sencor CSC1=NN=C(C(=O)N1N)C(C)(C)C InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3 FOXFZRUHNHCZPX-UHFFFAOYSA-N belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group. Aryl thioethers Organic compounds Organosulfur compounds Thioethers Aryl thioethers Aromatic heteromonocyclic compounds 1,2,4-triazines Alkylarylthioethers Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Lactams Organic oxides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds Sulfenyl compounds 1,2,4-triazine Alkylarylthioether Aromatic heteromonocyclic compound Aryl thioether Azacycle Heteroaromatic compound Hydrocarbon derivative Lactam Organic nitrogen compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Sulfenyl compound Triazine 1,2,4-triazines Triazine herbicides Triazinone herbicides cyclic ketone organic sulfide logp 1.54 ALOGPS logs -2.20 ALOGPS solubility 1.36e+00 g/l ALOGPS logp 1.96 ChemAxon pka_strongest_basic 2.46 ChemAxon iupac 4-amino-6-tert-butyl-3-(methylsulfanyl)-4,5-dihydro-1,2,4-triazin-5-one ChemAxon average_mass 214.288 ChemAxon mono_mass 214.08883178 ChemAxon smiles CSC1=NN=C(C(=O)N1N)C(C)(C)C ChemAxon formula C8H14N4OS ChemAxon inchi InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3 ChemAxon inchikey FOXFZRUHNHCZPX-UHFFFAOYSA-N ChemAxon polar_surface_area 71.05 ChemAxon refractivity 58 ChemAxon polarizability 22.08 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::NmrOneD 3520 Specdb::NmrOneD 3656 Specdb::EiMs 1482 Specdb::CMs 109528 Specdb::CMs 122327 Specdb::MsMs 101142 Specdb::MsMs 101143 Specdb::MsMs 101144 Specdb::MsMs 166677 Specdb::MsMs 166678 Specdb::MsMs 166679 Specdb::MsMs 2227270 Specdb::MsMs 2227315 Specdb::MsMs 2227419 Specdb::MsMs 2229625 Specdb::MsMs 2231604 Specdb::MsMs 2232051 Specdb::MsMs 2232608 Specdb::MsMs 2240747 Specdb::MsMs 2240957 Specdb::MsMs 2244926 Specdb::MsMs 2245168 Specdb::MsMs 2247078 Specdb::MsMs 2247241 Specdb::MsMs 2247247 Specdb::MsMs 2249157 Specdb::MsMs 2249204 Specdb::MsMs 2251162 Specdb::MsMs 2251265 Specdb::MsMs 2252788