5719-23-3
THIENO[3,4-D]PYRIMIDIN-4(3H)-ONE,5,7-DIHYDRO-2-METHYL-
NameTHIENO[3,4-D]PYRIMIDIN-4(3H)-ONE,5,7-DIHYDRO-2-METHYL-
1Identification
【Name】
THIENO[3,4-D]PYRIMIDIN-4(3H)-ONE,5,7-DIHYDRO-2-METHYL-
【CAS】
【MDL】
MFCD21607697
【English Synonyms】
【Formula】
C7 H8 N2 O S
【MolWeight】
168.219
【Inchi】
InChI=1S/C7H8N2OS/c1-4-8-6-3-11-2-5(6)7(10)9-4/h2-3H2,1H3,(H,8,9,10)
【InChIKey】
InChIKey=XBDCXZUSBJYHEP-UHFFFAOYSA-N
【SMILES】
Cc1[nH]c(=O)c2c(n1)CSC2
【MOL File】
THIENO[3,4-D]PYRIMID….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
THIENO[3,4-D]PYRIMIDIN-4(3H)-ONE,5,7-DIHYDRO-2-METHYL-.cml