477304-57-7
Product Name:
(1s,3s)-N-((4-ethyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)methyl)adamantane-1-carboxamide
Formula:
C17H26N4OS
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >50.2 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 334.5 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 334.18273264 g/mol |
| Monoisotopic Mass | 334.18273264 g/mol |
| Topological Polar Surface Area | 85.1 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 430 |
| 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 |