478261-99-3
Product Name:
ETHYL 7-(4-CHLOROPHENYL)-6-CYANO-5-OXO-3,5-DIHYDRO[1,2,4]TRIAZOLO[1,5-A]PYRIDINE-8-CARBOXYLATE
Formula:
C16H11ClN4O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 342.73 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 342.0519679 g/mol |
| Monoisotopic Mass | 342.0519679 g/mol |
| Topological Polar Surface Area | 94.8 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 723 |
| 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 |