TQC71TKJ43

5-methyl-2-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzenesulfonic acid

Also Known As: USAF K-2600|USAF K-26|2(1H)-Pyrimidinethione, 3,4-dihydro-1-(4-methyl-2-sulfophenyl)-4,4,6-trimethyl-|5-Methyl-2-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)benzenesulfonic acid|Benzenesulfonic acid, 2-(2-mercapto-4,4,6-trimethyl-1(4H)-pyrimidinyl)-5-methyl-|1-(2-Sulfo-4-methylphenyl)-2-thio-4,4,6-trimethyl dihydropyrimidine|1-(2-Sulfo-4-methylphenyl)-2-thio-4,6-trimethyl dihydropyrimidine|5-methyl-2-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)benzenesulfonic acid|Benzenesulfonic acid,4,6-trimethyl-1(4H)-pyrimidinyl)-5-methyl-|2(1H)-Pyrimidinethione,4-dihydro-1-(4-methyl-2-sulfophenyl)-4,4,6-trimethyl-|2-(3,4-Dihydro-4,4,6-trimethyl-2-thioxo-1(2H)-pyrimidinyl)-5-methylbenzenesulfonic acid|2-(1,2,3,4-Tetrahydro-4,4,6-trimethyl-2-thioxopyrimidin-1-yl)-5-methylbenzenesulfonic acid|5-methyl-2-(4,4,6-trimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-1-yl)benzene-1-sulfonic acid|5-Methyl-2-(4,4,6-trimethyl-2-sulfanylidene-3,4-dihydropyrimidin-1(2H)-yl)benzene-1-sulfonic acid|BENZENESULFONIC ACID, 2-(3,4-DIHYDRO-4,4,6-TRIMETHYL-2-THIOXO-1(2H)-PYRIMIDINYL)-5-METHYL-

Molecular Formula	C14H18N2O3S2
Molecular Weight	326.0759 g/mol
LogP	2.61862
Topological Polar Surface Area	69.64 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	326.0759
Monoisotopic Mass	326.0759
Heavy Atoms	21
Complexity	736.58606

Chemical Identifiers

CAS Number	6281-59-0
SMILES	CC1=CC(=C(C=C1)N2C(=CC(NC2=S)(C)C)C)S(=O)(=O)O