1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-N-(4-methoxyphenyl)-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-(4-methoxyphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-N-(4-methoxyphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Compound characteristics
| Compound ID: | V001-4285 |
| Compound Name: | 1-(1-benzylpiperidin-4-yl)-3-(butan-2-yl)-N-(4-methoxyphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide |
| Molecular Weight: | 549.78 |
| Molecular Formula: | C31 H43 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C)C1C(N(C2CCN(CC2)Cc2ccccc2)C2(CCN(CC2)C(Nc2ccc(cc2)OC)=S)N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9773 |
| logD: | 2.7636 |
| logSw: | -4.4788 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.77 |
| InChI Key: | QDDDAXGTAYFWPI-UHFFFAOYSA-N |