799778-37-3
Product Name:
10-ethyl-3-((4-fluorobenzyl)thio)-10-methyl-5-(methylthio)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Formula:
C21H21FN4OS3
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COMPUTED DESCRIPTORS
| Molecular Weight | 460.6 g/mol |
|---|---|
| XLogP3 | 6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 460.08615299 g/mol |
| Monoisotopic Mass | 460.08615299 g/mol |
| Topological Polar Surface Area | 131 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 613 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |