956193-66-1
Product Name:
ETHYL 1-(5-[(AMINOCARBOTHIOYL)AMINO]-2-PYRIDINYL)-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLATE
Formula:
C14H17N5O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 319.38 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 319.11029598 g/mol |
| Monoisotopic Mass | 319.11029598 g/mol |
| Topological Polar Surface Area | 127 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 422 |
| 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 |