1008857-93-9
Product Name:
[1-(2-CHLORO-ACETYL)-3-OXO-DECAHYDRO-QUINOXALIN-2-YL]-ACETIC ACID METHYL ESTER
Formula:
C13H19ClN2O4
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >45.4 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 302.75 g/mol |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 302.1033348 g/mol |
| Monoisotopic Mass | 302.1033348 g/mol |
| Topological Polar Surface Area | 75.7 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 415 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |