97361-19-8
8-(1-ETHYL-4-PIPERIDYL)THEOPHYLLINE HYDROCHLORIDE
Name8-(1-ETHYL-4-PIPERIDYL)THEOPHYLLINE HYDROCHLORIDE
FormulaC14 H21 N5 O2 . Cl H
1Identification
【Name】
8-(1-ETHYL-4-PIPERIDYL)THEOPHYLLINE HYDROCHLORIDE
【CAS】
【MDL】
MFCD01743029
【English Synonyms】
【Formula】
C14 H21 N5 O2 . Cl H
【MolWeight】
327.814
【Inchi】
InChI=1S/C14H21N5O2.ClH/c1-4-19-7-5-9(6-8-19)11-15-10-12(16-11)17(2)14(21)18(3)13(10)20;/h9H,4-8H2,1-3H3,(H,15,16);1H
【InChIKey】
InChIKey=IMZVVHCHRKENSX-UHFFFAOYSA-N
【SMILES】
CCN1CCC(CC1)c2[nH]c3c(n2)n(c(=O)n(c3=O)C)C.Cl
【MOL File】
8-(1-ETHYL-4-PIPERID….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
8-(1-ETHYL-4-PIPERIDYL)THEOPHYLLINE HYDROCHLORIDE.cml