590376-61-7
Product Name:
4-ALLYL-5-CYCLOHEXYL-4H-[1,2,4]TRIAZOLE-3-THIOL
Formula:
C11H17N3S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 24.5 [ug/mL] (The mean of the results at pH 7.4) |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 223.34 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 223.11431873 g/mol |
| Monoisotopic Mass | 223.11431873 g/mol |
| Topological Polar Surface Area | 59.7 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 292 |
| 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 |