2098090-94-7
Product Name:
Thiopyrano[4,3-c]pyrazole-1(4H)-acetonitrile, 6,7-dihydro-3-(3-thienyl)-
Formula:
C12H11N3S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 261.4 g/mol |
|---|---|
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 261.03943971 g/mol |
| Monoisotopic Mass | 261.03943971 g/mol |
| Topological Polar Surface Area | 95.2 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 327 |
| 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 |