871478-77-2
Product Name:
ethyl 2-(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)acetate
Formula:
C7H11N3O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 201.25 g/mol |
|---|---|
| XLogP3 | 0.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 201.05719778 g/mol |
| Monoisotopic Mass | 201.05719778 g/mol |
| Topological Polar Surface Area | 86 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 265 |
| 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 |