448198-57-0
Product Name:
2-((1-(4-acetoxyphenyl)-2,5-dioxopyrrolidin-3-yl)thio)nicotinic acid
Formula:
C18H14N2O6S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 386.4 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 386.05725734 g/mol |
| Monoisotopic Mass | 386.05725734 g/mol |
| Topological Polar Surface Area | 139 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 619 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |