1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-N-(3-methylphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Chemical Structure Depiction of
1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-N-(3-methylphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-N-(3-methylphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Compound characteristics
| Compound ID: | V028-2645 |
| Compound Name: | 1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-N-(3-methylphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide |
| Molecular Weight: | 533.78 |
| Molecular Formula: | C31 H43 N5 O S |
| Salt: | not_available |
| Smiles: | CCC(C)C1C(N(C2CCN(CC2)Cc2ccccc2)C2(CCN(CC2)C(Nc2cccc(C)c2)=S)N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3549 |
| logD: | 3.1412 |
| logSw: | -5.2072 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.226 |
| InChI Key: | GTCWYRVCLZXQMD-UHFFFAOYSA-N |