479074-07-2
Product Name:
3-(6,7-Dihydro-1-Methyl-3-propyl-7-thioxo-1H-pyrazolo[4,3-d]pyriMidin-5-yl)-4-ethoxy-benzenesulfonyl Chloride
Formula:
C17H19ClN4O3S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 426.9 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 426.0587105 g/mol |
| Monoisotopic Mass | 426.0587105 g/mol |
| Topological Polar Surface Area | 126 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 697 |
| 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 |