651292-55-6
Product Name:
ETHYL 5-(AMINOCARBOTHIOYL)-6-METHYL-2-(TRIFLUOROMETHYL)NICOTINATE
Formula:
C11H11F3N2O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 292.28 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 292.04933326 g/mol |
| Monoisotopic Mass | 292.04933326 g/mol |
| Topological Polar Surface Area | 97.3 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 362 |
| 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 |