899391-16-3
Product Name:
isopropyl 2-((5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)acetate
Formula:
C18H18ClN3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 391.9 g/mol |
|---|---|
| XLogP3 | 4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 8 |
| Exact Mass | 391.0757403 g/mol |
| Monoisotopic Mass | 391.0757403 g/mol |
| Topological Polar Surface Area | 95.4 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 471 |
| 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 |