5-benzyl-1-(3-chloro-4-fluorophenyl)-1,3,5-triazinane-2-thione
Chemical Structure Depiction of
5-benzyl-1-(3-chloro-4-fluorophenyl)-1,3,5-triazinane-2-thione
5-benzyl-1-(3-chloro-4-fluorophenyl)-1,3,5-triazinane-2-thione
Compound characteristics
| Compound ID: | 5701-2346 |
| Compound Name: | 5-benzyl-1-(3-chloro-4-fluorophenyl)-1,3,5-triazinane-2-thione |
| Molecular Weight: | 335.83 |
| Molecular Formula: | C16 H15 Cl F N3 S |
| Smiles: | C(c1ccccc1)N1CNC(N(C1)c1ccc(c(c1)[Cl])F)=S |
| Stereo: | ACHIRAL |
| logP: | 4.0633 |
| logD: | 4.0307 |
| logSw: | -4.3029 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 17.9324 |
| InChI Key: | PCROMJZZBMZTRA-UHFFFAOYSA-N |