685106-59-6
Product Name:
METHYL 4-OXO-5-(2-THIENYLMETHYL)-4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE-3-CARBOXYLATE
Formula:
C13H13N3O3S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >43.7 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 291.33 g/mol |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 291.06776246 g/mol |
| Monoisotopic Mass | 291.06776246 g/mol |
| Topological Polar Surface Area | 92.7 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 406 |
| 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 |