868224-47-9
Product Name:
Propanoic acid, 2-[[2-[2-[(2-fluorophenyl)amino]-2-oxoethyl]-1,2-dihydro-1-oxo-5-isoquinolinyl]oxy]-, ethyl ester
Formula:
C22H21FN2O5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 412.4 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 8 |
| Exact Mass | 412.14344994 g/mol |
| Monoisotopic Mass | 412.14344994 g/mol |
| Topological Polar Surface Area | 84.9 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 670 |
| 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 |