92286-36-7
Product Name:
4-Allyl-5-(3-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Formula:
C11H10ClN3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 251.74 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 251.0283962 g/mol |
| Monoisotopic Mass | 251.0283962 g/mol |
| Topological Polar Surface Area | 59.7 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 329 |
| 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 |