742118-92-9
Product Name:
2-chloro-5-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]sulfonyl}benzoic acid
Formula:
C15H15ClN2O6S3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 450.9 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 5 |
| Exact Mass | 449.9780774 g/mol |
| Monoisotopic Mass | 449.9780774 g/mol |
| Topological Polar Surface Area | 157 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 755 |
| 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 |