332051-32-8
Product Name:
N-(4-bromophenyl)-2-{[3-cyano-4-(3-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl]sulfanyl}acetamide
Formula:
C21H18BrN3O3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 472.4 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 471.02523 g/mol |
| Monoisotopic Mass | 471.02523 g/mol |
| Topological Polar Surface Area | 117 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 697 |
| 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 |