N-ethyl-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Chemical Structure Depiction of
N-ethyl-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
N-ethyl-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Compound characteristics
| Compound ID: | V026-0625 |
| Compound Name: | N-ethyl-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decane-8-carbothioamide |
| Molecular Weight: | 400.46 |
| Molecular Formula: | C18 H23 F3 N4 O S |
| Salt: | not_available |
| Smiles: | CCNC(N1CCC2(CC1)NCC(N2Cc1cccc(c1)C(F)(F)F)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 2.4542 |
| logD: | 2.0137 |
| logSw: | -2.8738 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.303 |
| InChI Key: | MKKQKEJJTADTHG-UHFFFAOYSA-N |