497060-85-2
Product Name:
3-((2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))METHYL)-4-(4-METHYLPHENYL)-1,2,4-TRIAZOLINE-5-THIONE
Formula:
C20H21N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 367.5 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 367.13544809 g/mol |
| Monoisotopic Mass | 367.13544809 g/mol |
| Topological Polar Surface Area | 78.2 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 571 |
| 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 |