478032-95-0
Product Name:
N-(1-BENZYL-3-CYANO-4,5-DIMETHYL-1H-PYRROL-2-YL)-2-THIOPHENECARBOXAMIDE
Formula:
C19H17N3OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 335.4 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 335.10923335 g/mol |
| Monoisotopic Mass | 335.10923335 g/mol |
| Topological Polar Surface Area | 86.1 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 496 |
| 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 |