N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N'-[3-(methylsulfanyl)phenyl]thiourea
Chemical Structure Depiction of
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N'-[3-(methylsulfanyl)phenyl]thiourea
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N'-[3-(methylsulfanyl)phenyl]thiourea
Compound characteristics
| Compound ID: | C270-0189 |
| Compound Name: | N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-N'-[3-(methylsulfanyl)phenyl]thiourea |
| Molecular Weight: | 418.6 |
| Molecular Formula: | C21 H27 F N4 S2 |
| Smiles: | CSc1cccc(c1)NC(NCCCN1CCN(CC1)c1ccc(cc1)F)=S |
| Stereo: | ACHIRAL |
| logP: | 3.8727 |
| logD: | 3.4293 |
| logSw: | -3.9333 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 27.4674 |
| InChI Key: | MDCBIIQQZWBRAU-UHFFFAOYSA-N |