325140-61-2
Product Name:
3-[4,6-DIMETHYL-3-(1H-PYRROL-1-YL)THIENO[2,3-B]PYRIDIN-2-YL]ACRYLONITRILE
Formula:
C16H13N3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 279.4 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 279.08301860 g/mol |
| Monoisotopic Mass | 279.08301860 g/mol |
| Topological Polar Surface Area | 69.8 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 421 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |