1401602-57-0
Product Name:
methyl 4-(2-((6-(azepan-1-ylmethyl)-4-oxo-4H-pyran-3-yl)oxy)acetamido)benzoate
Formula:
C22H26N2O6
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COMPUTED DESCRIPTORS
| Molecular Weight | 414.5 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 414.17908655 g/mol |
| Monoisotopic Mass | 414.17908655 g/mol |
| Topological Polar Surface Area | 94.2 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 686 |
| 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 |