91916-14-2
5,7-DIMETHYL-3-METHOXY-2-PHENYLTHIAZOLO(3,2-A)PYRIMIDIN-4-IUM PERCHLORATE
Name5,7-DIMETHYL-3-METHOXY-2-PHENYLTHIAZOLO(3,2-A)PYRIMIDIN-4-IUM PERCHLORATE
pro_formulaC15 H15 N2 O S . Cl O4
1Identification
【Name】
5,7-DIMETHYL-3-METHOXY-2-PHENYLTHIAZOLO(3,2-A)PYRIMIDIN-4-IUM PERCHLORATE
【CAS】
【MDL】
MFCD00725233
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H15 N2 O S . Cl O4
【pro_molWeight】
370.811
【Inchi】
InChI=1S/C15H15N2OS.ClHO4/c1-10-9-11(2)17-14(18-3)13(19-15(17)16-10)12-7-5-4-6-8-12;2-1(3,4)5/h4-9H,1-3H3;(H,2,3,4,5)/q+1;/p-1
【InChIKey】
InChIKey=JKDJKWXZBOAAQM-UHFFFAOYSA-M
【SMILES】
Cc1cc([n+]2c(c(sc2n1)c3ccccc3)OC)C.[O-]Cl(=O)(=O)=O
【MOL File】
5,7-DIMETHYL-3-METHO….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5,7-DIMETHYL-3-METHOXY-2-PHENYLTHIAZOLO(3,2-A)PYRIMIDIN-4-IUM PERCHLORATE.cml