7-[2-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]ethyl]theophyline

Modify Date: 2025-09-10 09:54:17

7-[2-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]ethyl]theophyline Structure
7-[2-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]ethyl]theophyline structure
Common Name 7-[2-[4-[(4-Chlorophenyl)methyl]-1-piperazinyl]ethyl]theophyline
CAS Number 19971-80-3 Molecular Weight 416.90500
Density 1.38g/cm3 Boiling Point 617.7ºC at 760 mmHg
Molecular Formula C20H25ClN6O2 Melting Point N/A
MSDS N/A Flash Point 327.4ºC

 Names

Name 7-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethyl]-1,3-dimethylpurine-2,6-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.38g/cm3
Boiling Point 617.7ºC at 760 mmHg
Molecular Formula C20H25ClN6O2
Molecular Weight 416.90500
Flash Point 327.4ºC
Exact Mass 416.17300
PSA 68.30000
LogP 0.78070
Vapour Pressure 3.45E-15mmHg at 25°C
Index of Refraction 1.676
InChIKey MSCBOUJTRMBGHM-UHFFFAOYSA-N
SMILES Cn1c(=O)c2c(ncn2CCN2CCN(Cc3ccc(Cl)cc3)CC2)n(C)c1=O

 Synonyms

7-{2-[4-(4-chloro-benzyl)-piperazin-1-yl]-ethyl}-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
7-{2-[4-(4-chlorobenzyl)piperazin-1-yl]ethyl}-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione
7-(2-(4-(p-Chlorobenzyl)-1-piperazinyl)ethyl)theophylline
Theophylline,7-(2-(4-(p-chlorobenzyl)-1-piperazinyl)ethyl)
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