57775-22-1
2-[3-[4-(3-CHLOROPHENYL)PIPERAZIN-1-YL]PROPYL]-4,5-DIETHYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE MONOHYDROCHLORIDE
Name2-[3-[4-(3-CHLOROPHENYL)PIPERAZIN-1-YL]PROPYL]-4,5-DIETHYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE MONOHYDROCHLORIDE
FormulaC19 H28 Cl N5 O . Cl H
1Identification
【Name】
2-[3-[4-(3-CHLOROPHENYL)PIPERAZIN-1-YL]PROPYL]-4,5-DIETHYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE MONOHYDROCHLORIDE
【CAS】
【MDL】
MFCD01678245
【English Synonyms】
【Formula】
C19 H28 Cl N5 O . Cl H
【MolWeight】
414.378
【Inchi】
InChI=1S/C19H28ClN5O.ClH/c1-3-18-21-25(19(26)24(18)4-2)10-6-9-22-11-13-23(14-12-22)17-8-5-7-16(20)15-17;/h5,7-8,15H,3-4,6,9-14H2,1-2H3;1H
【InChIKey】
InChIKey=BHKPQZVLIZKSAG-UHFFFAOYSA-N
【SMILES】
CCc1nn(c(=O)n1CC)CCCN2CCN(CC2)c3cccc(c3)Cl.Cl
【MOL File】
2-[3-[4-(3-CHLOROPHE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-[3-[4-(3-CHLOROPHENYL)PIPERAZIN-1-YL]PROPYL]-4,5-DIETHYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE MONOHYDROCHLORIDE.cml