955866-08-7
Product Name:
4-(2-chlorophenyl)-3-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1H-1,2,4-triazole-5-thione
Formula:
C18H14ClN5OS
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 383.9 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 383.0607590 g/mol |
| Monoisotopic Mass | 383.0607590 g/mol |
| Topological Polar Surface Area | 97.6 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 554 |
| 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 |