477887-85-7
Product Name:
3-[(4-CHLOROBENZYL)SULFANYL]-5-(4,5-DIHYDRONAPHTHO[1,2-B]THIOPHEN-2-YL)-4-ETHYL-4H-1,2,4-TRIAZOLE
Formula:
C23H20ClN3S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 438.0 g/mol |
|---|---|
| XLogP3 | 6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 437.0787177 g/mol |
| Monoisotopic Mass | 437.0787177 g/mol |
| Topological Polar Surface Area | 84.2 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 544 |
| 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 |