478261-70-0
Product Name:
2-[(2,6-DICHLOROBENZYL)SULFANYL]-4-HYDROXY-6-PHENYL-5-PYRIMIDINECARBONITRILE
Formula:
C18H11Cl2N3OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 388.3 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 386.9999885 g/mol |
| Monoisotopic Mass | 386.9999885 g/mol |
| Topological Polar Surface Area | 90.6 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 624 |
| 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 |