76360-81-1
ETHYL 5-HYDROXY-8-METHYL-2-(METHYLTHIO)-7-OXO-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLATE
NameETHYL 5-HYDROXY-8-METHYL-2-(METHYLTHIO)-7-OXO-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLATE
pro_formulaC12 H13 N3 O4 S
1Identification
【Name】
ETHYL 5-HYDROXY-8-METHYL-2-(METHYLTHIO)-7-OXO-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLATE
【CAS】
【MDL】
MFCD17011938
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C12 H13 N3 O4 S
【pro_molWeight】
295.318
【Inchi】
InChI=1S/C12H13N3O4S/c1-4-19-11(18)7-8(16)6-5-13-12(20-3)14-9(6)15(2)10(7)17/h5,16H,4H2,1-3H3
【InChIKey】
InChIKey=DYADCDHHJJBFRO-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(c2cnc(nc2n(c1=O)C)SC)O
【MOL File】
ETHYL 5-HYDROXY-8-ME….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:0.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
ETHYL 5-HYDROXY-8-METHYL-2-(METHYLTHIO)-7-OXO-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLATE.cml