110062-45-8
Product Name:
5-MERCAPTO-4-(2-PHENYLETHYL)-4H-1,2,4-TRIAZOL-3-OL
Formula:
C10H11N3OS
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 221.28 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 221.06228316 g/mol |
| Monoisotopic Mass | 221.06228316 g/mol |
| Topological Polar Surface Area | 76.5 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 263 |
| 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 |