573975-28-7
Product Name:
2-[2-(cyanomethylsulfanyl)-4-oxoquinazolin-3-yl]oxyacetonitrile
Formula:
C12H8N4O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 272.28 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 272.03679668 g/mol |
| Monoisotopic Mass | 272.03679668 g/mol |
| Topological Polar Surface Area | 115 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 486 |
| 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 |