N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0520 |
| Compound Name: | N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide |
| Molecular Weight: | 465.59 |
| Molecular Formula: | C25 H28 F N5 O S |
| Smiles: | CSc1ncc(C(NCCCN2CCN(CC2)c2ccc(cc2)F)=O)c(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.9389 |
| logD: | 3.395 |
| logSw: | -3.8313 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.05 |
| InChI Key: | GDXQGHFZMJUGSA-UHFFFAOYSA-N |