339017-78-6
Product Name:
ETHYL 4-[6-CHLORO-2-(METHYLSULFANYL)-4-PYRIMIDINYL]TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
Formula:
C12H17ClN4O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 316.81 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 316.0760747 g/mol |
| Monoisotopic Mass | 316.0760747 g/mol |
| Topological Polar Surface Area | 83.9 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 329 |
| 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 |