501351-41-3
Product Name:
6-Mercapto-2-(4-nitro-phenyl)-4-oxo-1-phenyl-1,2,3,4-tetrahydro-pyrimidine-5-carbonitrile
Formula:
C17H12N4O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 352.4 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 352.06301143 g/mol |
| Monoisotopic Mass | 352.06301143 g/mol |
| Topological Polar Surface Area | 103 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 622 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |