488825-04-3
Product Name:
ethyl 2-(3-ethyl-6-iodo-4-oxoquinazolin-2-yl)sulfanylacetate
Formula:
C14H15IN2O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 418.25 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 417.98481 g/mol |
| Monoisotopic Mass | 417.98481 g/mol |
| Topological Polar Surface Area | 84.3 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 444 |
| 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 |