43088-52-4
3-AMINO-2-METHYL-5,6,7,8-TETRAHYDRO-3H-BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE
Name3-AMINO-2-METHYL-5,6,7,8-TETRAHYDRO-3H-BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE
1Identification
【Name】
3-AMINO-2-METHYL-5,6,7,8-TETRAHYDRO-3H-BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE
【CAS】
【MDL】
MFCD00458476
【English Synonyms】
【Formula】
C11 H13 N3 O S
【MolWeight】
235.31
【Inchi】
InChI=1S/C11H13N3OS/c1-6-13-10-9(11(15)14(6)12)7-4-2-3-5-8(7)16-10/h2-5,12H2,1H3
【InChIKey】
InChIKey=CZRSWELKXRQSMW-UHFFFAOYSA-N
【SMILES】
Cc1nc2c(c3c(s2)CCCC3)c(=O)n1N
【MOL File】
3-AMINO-2-METHYL-5,6….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-AMINO-2-METHYL-5,6,7,8-TETRAHYDRO-3H-BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE.cml