1-[2-(3,4-diethoxyphenyl)ethyl]-5-[(furan-2-yl)methyl]-1,3,5-triazinane-2-thione
Chemical Structure Depiction of
1-[2-(3,4-diethoxyphenyl)ethyl]-5-[(furan-2-yl)methyl]-1,3,5-triazinane-2-thione
1-[2-(3,4-diethoxyphenyl)ethyl]-5-[(furan-2-yl)methyl]-1,3,5-triazinane-2-thione
Compound characteristics
| Compound ID: | Y502-0847 |
| Compound Name: | 1-[2-(3,4-diethoxyphenyl)ethyl]-5-[(furan-2-yl)methyl]-1,3,5-triazinane-2-thione |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C20 H27 N3 O3 S |
| Smiles: | CCOc1ccc(CCN2CN(Cc3ccco3)CNC2=S)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.9777 |
| logD: | 2.5464 |
| logSw: | -3.202 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.526 |
| InChI Key: | FPZVVSCGPHPSSY-UHFFFAOYSA-N |