508169-18-4
7-CHLOROMETHYLOXY-CARBONYLOXY-6-(5-CHLOROPYRIDIN-2-YL)-6,7-DIHYDRO-5H-PYRROLO[3,4-B]PYRAZIN-5-ONE
Name7-CHLOROMETHYLOXY-CARBONYLOXY-6-(5-CHLOROPYRIDIN-2-YL)-6,7-DIHYDRO-5H-PYRROLO[3,4-B]PYRAZIN-5-ONE
pro_formulaC13 H8 Cl2 N4 O4
1Identification
【Name】
7-CHLOROMETHYLOXY-CARBONYLOXY-6-(5-CHLOROPYRIDIN-2-YL)-6,7-DIHYDRO-5H-PYRROLO[3,4-B]PYRAZIN-5-ONE
【CAS】
【MDL】
MFCD12031576
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13 H8 Cl2 N4 O4
【pro_molWeight】
355.136
【Inchi】
InChI=1S/C13H8Cl2N4O4/c14-6-22-13(21)23-12-10-9(16-3-4-17-10)11(20)19(12)8-2-1-7(15)5-18-8/h1-5,12H,6H2
【InChIKey】
InChIKey=LTLOOQRIMYDJAP-UHFFFAOYSA-N
【SMILES】
c1cc(ncc1Cl)N2C(c3c(nccn3)C2=O)OC(=O)OCCl
【MOL File】
7-CHLOROMETHYLOXY-CA….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:8
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
7-CHLOROMETHYLOXY-CARBONYLOXY-6-(5-CHLOROPYRIDIN-2-YL)-6,7-DIHYDRO-5H-PYRROLO[3,4-B]PYRAZIN-5-ONE.cml