93764-93-3
Product Name:
Ethyl 5-amino-4-cyano-1-phenyl-1H-pyrazole-3-carboxylate
Formula:
C13H12N4O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 256.26 g/mol |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 256.09602564 g/mol |
| Monoisotopic Mass | 256.09602564 g/mol |
| Topological Polar Surface Area | 93.9 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 372 |
| 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 |