370077-95-5
Product Name:
octyl 2-((3-cyano-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl)thio)acetate
Formula:
C22H32N2O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 388.6 g/mol |
|---|---|
| XLogP3 | 7.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 11 |
| Exact Mass | 388.21844944 g/mol |
| Monoisotopic Mass | 388.21844944 g/mol |
| Topological Polar Surface Area | 88.3 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 476 |
| 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 |