3-benzyl-N-(3-chlorophenyl)-1-methyl-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Chemical Structure Depiction of
3-benzyl-N-(3-chlorophenyl)-1-methyl-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
3-benzyl-N-(3-chlorophenyl)-1-methyl-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Compound characteristics
| Compound ID: | V029-0694 |
| Compound Name: | 3-benzyl-N-(3-chlorophenyl)-1-methyl-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide |
| Molecular Weight: | 428.98 |
| Molecular Formula: | C22 H25 Cl N4 O S |
| Salt: | not_available |
| Smiles: | CN1C(C(Cc2ccccc2)NC12CCN(CC2)C(Nc1cccc(c1)[Cl])=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8379 |
| logD: | 3.3018 |
| logSw: | -4.2913 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.336 |
| InChI Key: | QAIDZNJMAPQWBR-LJQANCHMSA-N |