1008081-01-3
Product Name:
2-ACETYL-1,1-DIMETHYL-2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE-3-CARBOXYLIC ACID
Formula:
C16H18N2O3
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >42.9 [ug/mL] (The mean of the results at pH 7.4) |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 286.33 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 286.13174244 g/mol |
| Monoisotopic Mass | 286.13174244 g/mol |
| Topological Polar Surface Area | 73.4 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 462 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |