525582-53-0
Product Name:
3-[(4-ETHYL-5-THIEN-2-YL-4H-1,2,4-TRIAZOL-3-YL)THIO]-4-PHENYLQUINOLIN-2(1H)-ONE
Formula:
C23H18N4OS2
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COMPUTED DESCRIPTORS
| Molecular Weight | 430.5 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 430.09220356 g/mol |
| Monoisotopic Mass | 430.09220356 g/mol |
| Topological Polar Surface Area | 113 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 666 |
| 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 |