609794-31-2
2-METHOXYETHYL 8-METHYL-4-OXO-6-(3,4,5-TRIMETHOXYPHENYL)-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE
Name2-METHOXYETHYL 8-METHYL-4-OXO-6-(3,4,5-TRIMETHOXYPHENYL)-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE
1Identification
【Name】
2-METHOXYETHYL 8-METHYL-4-OXO-6-(3,4,5-TRIMETHOXYPHENYL)-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE
【CAS】
【MDL】
MFCD03530058
【English Synonyms】
【Formula】
C21 H26 N2 O7 S
【MolWeight】
450.509
【Inchi】
InChI=1S/C21H26N2O7S/c1-12-17(20(25)30-8-7-26-2)18(23-16(24)6-9-31-21(23)22-12)13-10-14(27-3)19(29-5)15(11-13)28-4/h10-11,18H,6-9H2,1-5H3
【InChIKey】
InChIKey=RKWRJVROIXMPLP-UHFFFAOYSA-N
【SMILES】
CC1=C(C(N2C(=O)CCSC2=N1)c3cc(c(c(c3)OC)OC)OC)C(=O)OCCOC
【MOL File】
2-METHOXYETHYL 8-MET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:9
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-METHOXYETHYL 8-METHYL-4-OXO-6-(3,4,5-TRIMETHOXYPHENYL)-3,4-DIHYDRO-2H,6H-PYRIMIDO[2,1-B][1,3]THIAZINE-7-CARBOXYLATE.cml