723322-83-6
Product Name:
2-[[4-azaniumyl-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
Formula:
C11H12N4O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 280.31 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 280.06301143 g/mol |
| Monoisotopic Mass | 280.06301143 g/mol |
| Topological Polar Surface Area | 129 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 320 |
| 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 |