571149-75-2
Product Name:
5-Pyrimidinepropanenitrile, 6-amino-3-ethyl-1,2,3,4-tetrahydro-β,2,4-trioxo-1-(phenylmethyl)-
Formula:
C16H16N4O3
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 4.1 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 312.32 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 312.12224039 g/mol |
| Monoisotopic Mass | 312.12224039 g/mol |
| Topological Polar Surface Area | 108 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 596 |
| 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 |