832126-18-8
Product Name:
4-ETHYL-5-(2-PHENYL-CYCLOPROPYL)-4 H-[1,2,4]TRIAZOLE-3-THIOL
Formula:
C13H15N3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 245.35 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 245.09866866 g/mol |
| Monoisotopic Mass | 245.09866866 g/mol |
| Topological Polar Surface Area | 59.7 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 347 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |