1-[2-(3,4-dimethoxyphenyl)ethyl]-2-oxo-N-(propan-2-yl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Chemical Structure Depiction of
1-[2-(3,4-dimethoxyphenyl)ethyl]-2-oxo-N-(propan-2-yl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
1-[2-(3,4-dimethoxyphenyl)ethyl]-2-oxo-N-(propan-2-yl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Compound characteristics
| Compound ID: | V028-8112 |
| Compound Name: | 1-[2-(3,4-dimethoxyphenyl)ethyl]-2-oxo-N-(propan-2-yl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide |
| Molecular Weight: | 420.57 |
| Molecular Formula: | C21 H32 N4 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)NC(N1CCC2(CC1)NCC(N2CCc1ccc(c(c1)OC)OC)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 1.8092 |
| logD: | 0.3311 |
| logSw: | -2.4861 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.891 |
| InChI Key: | FOAOPKCJLFEMSY-UHFFFAOYSA-N |