110714-10-8
2-(3-(BENZO(1,4)DIOXAN-2-YLMETHYLAMINO)-1-PROPYL)-3(2H)-PYRIDAZINONE HYDROCHLORIDE
Name2-(3-(BENZO(1,4)DIOXAN-2-YLMETHYLAMINO)-1-PROPYL)-3(2H)-PYRIDAZINONE HYDROCHLORIDE
FormulaC16 H19 N3 O3 . Cl H
1Identification
【Name】
2-(3-(BENZO(1,4)DIOXAN-2-YLMETHYLAMINO)-1-PROPYL)-3(2H)-PYRIDAZINONE HYDROCHLORIDE
【CAS】
【MDL】
MFCD01692698
【English Synonyms】
【Formula】
C16 H19 N3 O3 . Cl H
【MolWeight】
337.805
【Inchi】
InChI=1S/C16H19N3O3.ClH/c20-16-7-3-9-18-19(16)10-4-8-17-11-13-12-21-14-5-1-2-6-15(14)22-13;/h1-3,5-7,9,13,17H,4,8,10-12H2;1H
【InChIKey】
InChIKey=WJDFSAOMSJHHCG-UHFFFAOYSA-N
【SMILES】
c1ccc2c(c1)OCC(O2)CNCCCn3c(=O)cccn3.Cl
【MOL File】
2-(3-(BENZO(1,4)DIOX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(3-(BENZO(1,4)DIOXAN-2-YLMETHYLAMINO)-1-PROPYL)-3(2H)-PYRIDAZINONE HYDROCHLORIDE.cml