536704-21-9
Product Name:
2-((2-oxo-2-phenylethyl)thio)-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Formula:
C24H17N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 411.5 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 411.10414797 g/mol |
| Monoisotopic Mass | 411.10414797 g/mol |
| Topological Polar Surface Area | 90.8 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 684 |
| 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 |