609794-74-3
2-METHOXYETHYL 6-[4-(ACETYLOXY)-3-ETHOXYPHENYL]-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE
Name2-METHOXYETHYL 6-[4-(ACETYLOXY)-3-ETHOXYPHENYL]-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE
pro_formulaC22 H26 N2 O7 S
1Identification
【Name】
2-METHOXYETHYL 6-[4-(ACETYLOXY)-3-ETHOXYPHENYL]-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE
【CAS】
【MDL】
MFCD03530091
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C22 H26 N2 O7 S
【pro_molWeight】
462.52
【Inchi】
InChI=1S/C22H26N2O7S/c1-5-29-17-12-15(6-7-16(17)31-14(3)25)20-19(21(27)30-10-9-28-4)13(2)23-22-24(20)18(26)8-11-32-22/h6-7,12,20H,5,8-11H2,1-4H3
【InChIKey】
InChIKey=BFKIFIZWGVJEAP-UHFFFAOYSA-N
【SMILES】
CCOc1cc(ccc1OC(=O)C)C2C(=C(N=C3N2C(=O)CCS3)C)C(=O)OCCOC
【MOL File】
2-METHOXYETHYL 6-[4-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:9
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-METHOXYETHYL 6-[4-(ACETYLOXY)-3-ETHOXYPHENYL]-8-METHYL-4-OXO-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE.cml