893787-37-6
Product Name:
2-chloro-5-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid
Formula:
C17H14ClN3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 375.8 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 375.0444402 g/mol |
| Monoisotopic Mass | 375.0444402 g/mol |
| Topological Polar Surface Area | 106 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 551 |
| 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 |