136199-02-5
Product Name:
1,3-dipropyl-8-(3-noradamantyl)xanthine
Formula:
C20H28N4O2
Synonyms:
1,3-dipropyl-8-(3-noradamantyl)xanthine;8-(Hexahydro-2,5-methanopentalen-3a(1H)-yl)-3,7-dihydro-1,3-dipropyl-1H-purine-2,6-dione;MK-7418;Rolofylline
Inquiry
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H413:Hazardous to the aquatic environment, long-term hazard |
COMPUTED DESCRIPTORS
| Molecular Weight | 356.5 g/mol |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 356.22122615 g/mol |
| Monoisotopic Mass | 356.22122615 g/mol |
| Topological Polar Surface Area | 69.3 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 609 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Rolofylline is an oxopurine.