1-(3-chloro-4-fluorophenyl)-5-[(pyridin-3-yl)methyl]-1,3,5-triazinane-2-thione
Chemical Structure Depiction of
1-(3-chloro-4-fluorophenyl)-5-[(pyridin-3-yl)methyl]-1,3,5-triazinane-2-thione
1-(3-chloro-4-fluorophenyl)-5-[(pyridin-3-yl)methyl]-1,3,5-triazinane-2-thione
Compound characteristics
| Compound ID: | Y207-5565 |
| Compound Name: | 1-(3-chloro-4-fluorophenyl)-5-[(pyridin-3-yl)methyl]-1,3,5-triazinane-2-thione |
| Molecular Weight: | 336.82 |
| Molecular Formula: | C15 H14 Cl F N4 S |
| Smiles: | C(c1cccnc1)N1CNC(N(C1)c1ccc(c(c1)[Cl])F)=S |
| Stereo: | ACHIRAL |
| logP: | 2.7501 |
| logD: | 2.7425 |
| logSw: | -3.3814 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.4502 |
| InChI Key: | HOWVPNXODGARJQ-UHFFFAOYSA-N |