5-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-phenylethyl)-1,3,5-triazinane-2-thione
Chemical Structure Depiction of
5-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-phenylethyl)-1,3,5-triazinane-2-thione
5-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-phenylethyl)-1,3,5-triazinane-2-thione
Compound characteristics
| Compound ID: | 8019-1188 |
| Compound Name: | 5-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-phenylethyl)-1,3,5-triazinane-2-thione |
| Molecular Weight: | 385.53 |
| Molecular Formula: | C21 H27 N3 O2 S |
| Smiles: | COc1ccc(CCN2CNC(N(CCc3ccccc3)C2)=S)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.3022 |
| logD: | 2.4572 |
| logSw: | -3.5517 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.596 |
| InChI Key: | QCDKQZMKCOLFQR-UHFFFAOYSA-N |