1353498-80-2
Product Name:
Thieno[2,3-c]pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-2-iodo-6-(2,2,2-trifluoroacetyl)-, methyl ester
Formula:
C11H9F3INO3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 419.16 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 418.93000 g/mol |
| Monoisotopic Mass | 418.93000 g/mol |
| Topological Polar Surface Area | 74.8 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 420 |
| 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 |