921159-94-6
Product Name:
2-{1-[8,9-dimethyl-7-(2-methylpropyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-3-(methylsulfanyl)propyl}-1H-isoindole-1,3(2H)-dione
Formula:
C25H28N6O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 476.6 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 476.19944533 g/mol |
| Monoisotopic Mass | 476.19944533 g/mol |
| Topological Polar Surface Area | 111 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 759 |
| 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 |