898987-69-4
Product Name:
Benzenepropanoic acid, 2-bromo-β-[(2,4-dimethoxyphenyl)amino]-3,4,5-trimethoxy-, ethyl ester
Formula:
C22H28BrNO7
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 498.4 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 12 |
| Exact Mass | 497.10491 g/mol |
| Monoisotopic Mass | 497.10491 g/mol |
| Topological Polar Surface Area | 84.5 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 540 |
| 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 |