8-(2-ethylhexanoyl)-4-[3-(trifluoromethyl)phenyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one
Chemical Structure Depiction of
8-(2-ethylhexanoyl)-4-[3-(trifluoromethyl)phenyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one
8-(2-ethylhexanoyl)-4-[3-(trifluoromethyl)phenyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one
Compound characteristics
| Compound ID: | V009-1801 |
| Compound Name: | 8-(2-ethylhexanoyl)-4-[3-(trifluoromethyl)phenyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C22 H29 F3 N2 O2 S |
| Smiles: | CCCCC(CC)C(N1CCC2(CC1)N(C(CS2)=O)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9419 |
| logD: | 4.9419 |
| logSw: | -4.7359 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.839 |
| InChI Key: | ZVYKNJWWCWCFGW-INIZCTEOSA-N |