175202-35-4
Product Name:
5-(4-BROMO-3,5-DIMETHYLPYRAZOL-1-YLMETHYL)-4-METHYL-1,2,4-TRIAZOLE-3-THIOL
Formula:
C9H12BrN5S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 302.20 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 300.99968 g/mol |
| Monoisotopic Mass | 300.99968 g/mol |
| Topological Polar Surface Area | 77.5 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 334 |
| 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 |