478063-75-1
Product Name:
ETHYL 2-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-3-[(4-FLUOROBENZYL)AMINO]-3-OXOPROPANOATE
Formula:
C18H15ClF4N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 418.8 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 418.0707327 g/mol |
| Monoisotopic Mass | 418.0707327 g/mol |
| Topological Polar Surface Area | 68.3 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 541 |
| 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 |