Product
Supplier
Encyclopedia
Inquiry
Home > Encyclopedia > [1-(1,3-dimethyl-2,6-dioxopurin-7-yl)-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propan-2-yl] benzoate

[1-(1,3-dimethyl-2,6-dioxopurin-7-yl)-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propan-2-yl] benzoate

[1-(1,3-dimethyl-2,6-dioxopurin-7-yl)-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propan-2-yl] benzoate structure

[1-(1,3-dimethyl-2,6-dioxopurin-7-yl)-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propan-2-yl] benzoate 

structure
  • CAS No:

    19977-12-9

  • Formula:

    C31H38N6O4

  • Chemical Name:

    [1-(1,3-dimethyl-2,6-dioxopurin-7-yl)-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propan-2-yl] benzoate

  • Synonyms:

    7-{2-benzoyloxy-3-[4-(4-isopropyl-benzyl)-piperazin-1-yl]-propyl}-1,3-dimethyl-3,7-dihydro-purine-2,6-dione; 1-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7h-purin-7-yl)-3-{4-[4-(propan-2-yl)benzyl]piperazin-1-yl}propan-2-yl benzoate; Theophylline,7-(2-benzoyloxy-3-(4-(p-isopropylbenzyl)-1-piperazinyl)propyl);

[1-(1,3-dimethyl-2,6-dioxopurin-7-yl)-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propan-2-yl] benzoate Basic Attributes

558.67100

558.29545371 g/mol

Characteristics

94.60000

2.47630

1.26g/cm3

731.3ºC

396.1ºC

1.637

3.03E-21mmHg at 25°C

Computed Properties

Molecular Weight:558.7
XLogP3:3.6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:558.29545371
Monoisotopic Mass:558.29545371
Topological Polar Surface Area:91.2
Heavy Atom Count:41
Complexity:910
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [1-(1,3-dimethyl-2,6-dioxopurin-7-yl)-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propan-2-yl] benzoate

Request for Quotation

Share

Scan the QR Code to Share

Feedback & Suggestions
Send Message

Thank you for your feedback. If you require further assistance, please contact us by email at info@echemi.com or call us at +86-532-55729510.