731827-13-7
Product Name:
3H-1,2,4-Triazole-3-thione, 4-(4-ethoxyphenyl)-2,4-dihydro-5-(2-methoxyphenyl)-
Formula:
C17H17N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 327.4 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 327.10414797 g/mol |
| Monoisotopic Mass | 327.10414797 g/mol |
| Topological Polar Surface Area | 78.2 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 449 |
| 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 |