459421-25-1
Product Name:
2-((1-butyl-2,5-dioxopyrrolidin-3-yl)thio)benzoic acid
Formula:
C15H17NO4S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 307.4 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 307.08782920 g/mol |
| Monoisotopic Mass | 307.08782920 g/mol |
| Topological Polar Surface Area | 100 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 426 |
| 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 |