70541-99-0
Product Name:
5-CYANO-4-METHYL-3-PHENYL-2-THIOPHENECARBOXAMIDE
Formula:
C13H10N2OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 242.30 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 242.05138412 g/mol |
| Monoisotopic Mass | 242.05138412 g/mol |
| Topological Polar Surface Area | 95.1 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 343 |
| 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 |