952182-38-6
BENZYL 4-(5-CHLORO-6-OXO-1,6-DIHYDRO-4-PYRIDAZINYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
NameBENZYL 4-(5-CHLORO-6-OXO-1,6-DIHYDRO-4-PYRIDAZINYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
pro_formulaC16 H17 Cl N4 O3
1Identification
【Name】
BENZYL 4-(5-CHLORO-6-OXO-1,6-DIHYDRO-4-PYRIDAZINYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
【CAS】
【MDL】
MFCD09864817
【EnglishSynonyms】
【pro_formula】
C16 H17 Cl N4 O3
【pro_molWeight】
348.788
【Inchi】
InChI=1S/C16H17ClN4O3/c17-14-13(10-18-19-15(14)22)20-6-8-21(9-7-20)16(23)24-11-12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H,19,22)
【InChIKey】
InChIKey=LNTJVCKNMXWBEK-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)COC(=O)N2CCN(CC2)c3cn[nH]c(=O)c3Cl
【MOL File】
BENZYL 4-(5-CHLORO-6….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:0.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
BENZYL 4-(5-CHLORO-6-OXO-1,6-DIHYDRO-4-PYRIDAZINYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE.cml