338960-09-1
Product Name:
2-(TERT-BUTYL)-4-(2-CHLORO-6-FLUOROPHENYL)-6-OXO-1,4,5,6-TETRAHYDRO-3-PYRIDINECARBONITRILE
Formula:
C16H16ClFN2O
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 306.76 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 306.0935190 g/mol |
| Monoisotopic Mass | 306.0935190 g/mol |
| Topological Polar Surface Area | 52.9 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 514 |
| 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 |