609795-82-6
ETHYL 6-(4-ETHYLPHENYL)-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE
NameETHYL 6-(4-ETHYLPHENYL)-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE
pro_formulaC19 H22 N2 O3 S
1Identification
【Name】
ETHYL 6-(4-ETHYLPHENYL)-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE
【CAS】
【MDL】
MFCD03530094
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C19 H22 N2 O3 S
【pro_molWeight】
358.46
【Inchi】
InChI=1S/C19H22N2O3S/c1-4-13-6-8-14(9-7-13)17-16(18(23)24-5-2)12(3)20-19-21(17)15(22)10-11-25-19/h6-9,17H,4-5,10-11H2,1-3H3
【InChIKey】
InChIKey=RELPQMZRWUWADF-UHFFFAOYSA-N
【SMILES】
CCc1ccc(cc1)C2C(=C(N=C3N2C(=O)CCS3)C)C(=O)OCC
【MOL File】
ETHYL 6-(4-ETHYLPHEN….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:5
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
ETHYL 6-(4-ETHYLPHENYL)-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE.cml