674362-11-9
Product Name:
5-(benzylthio)-3-((4-nitrobenzyl)thio)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Formula:
C25H21N5O2S3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 519.7 g/mol |
|---|---|
| XLogP3 | 7.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 519.08573845 g/mol |
| Monoisotopic Mass | 519.08573845 g/mol |
| Topological Polar Surface Area | 168 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 730 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |