9-{3-[4-(p-chlorobenzyl)-1-piperazinyl]propyl}-1-methylisoguanine

SpectraBase Compound ID	9DgjK2F2tpR
InChI	InChI=1S/C20H26ClN7O/c1-25-18(22)17-19(24-20(25)29)28(14-23-17)8-2-7-26-9-11-27(12-10-26)13-15-3-5-16(21)6-4-15/h3-6,14,22H,2,7-13H2,1H3,(H,24,29)
InChIKey	PDFRCOLXGPPZTL-UHFFFAOYSA-N Google Search
Mol Weight	415.93 g/mol
Molecular Formula	C20H26ClN7O
Exact Mass	415.188736 g/mol

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SpectraBase Spectrum ID	EeLYOoGuw4o
Name	9-{3-[4-(p-CHLOROBENZYL)-1-PIPERAZINYL]PROPYL}-1-METHYLISOGUANINE
Source of Sample	K. Grozinger, Boehringer Ingelheim Ltd., Ridgefield, Connecticut
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H26ClN7O
InChI	InChI=1S/C20H26ClN7O/c1-25-18(22)17-19(24-20(25)29)28(14-23-17)8-2-7-26-9-11-27(12-10-26)13-15-3-5-16(21)6-4-15/h3-6,14,22H,2,7-13H2,1H3,(H,24,29)
InChIKey	PDFRCOLXGPPZTL-UHFFFAOYSA-N
Literature Reference	EUR. J. MED. CHEM. 18, 221(1983) Abstract-Chemical Abstracts= 99, 158109W(1983)
Melting Point	229-231C
Molecular Weight	415.925995
Synonyms	ISOGUANINE, 9-/3-/4-/P-CHLORO- BENZYL/-1-PIPERAZINYL/PROPYL/- 1-METHYL-,
Technique	KBr WAFER