3-(butan-2-yl)-N-(2-fluorophenyl)-2-oxo-1-(prop-2-en-1-yl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Chemical Structure Depiction of
3-(butan-2-yl)-N-(2-fluorophenyl)-2-oxo-1-(prop-2-en-1-yl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
3-(butan-2-yl)-N-(2-fluorophenyl)-2-oxo-1-(prop-2-en-1-yl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Compound characteristics
| Compound ID: | V027-9901 |
| Compound Name: | 3-(butan-2-yl)-N-(2-fluorophenyl)-2-oxo-1-(prop-2-en-1-yl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide |
| Molecular Weight: | 404.55 |
| Molecular Formula: | C21 H29 F N4 O S |
| Salt: | not_available |
| Smiles: | CCC(C)C1C(N(CC=C)C2(CCN(CC2)C(Nc2ccccc2F)=S)N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7982 |
| logD: | 2.5801 |
| logSw: | -3.9181 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.016 |
| InChI Key: | XVEQQBCZEHFSMY-UHFFFAOYSA-N |