18593-45-8
2,5,6-TRIMETHYL-3H,4H-THIENO[2,3-D]PYRIMIDIN-4-ONE
Name2,5,6-TRIMETHYL-3H,4H-THIENO[2,3-D]PYRIMIDIN-4-ONE
1Identification
【Name】
2,5,6-TRIMETHYL-3H,4H-THIENO[2,3-D]PYRIMIDIN-4-ONE
【CAS】
【MDL】
MFCD00457518
【English Synonyms】
【Formula】
C9 H10 N2 O S
【MolWeight】
194.257
【Inchi】
InChI=1S/C9H10N2OS/c1-4-5(2)13-9-7(4)8(12)10-6(3)11-9/h1-3H3,(H,10,11,12)
【InChIKey】
InChIKey=ONHXPYXOJCRCBR-UHFFFAOYSA-N
【SMILES】
Cc1c(sc2c1c(=O)[nH]c(n2)C)C
【MOL File】
2,5,6-TRIMETHYL-3H,4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,5,6-TRIMETHYL-3H,4H-THIENO[2,3-D]PYRIMIDIN-4-ONE.cml