3-({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}amino)-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}amino)-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
3-({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}amino)-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-3033 |
| Compound Name: | 3-({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}amino)-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 484.64 |
| Molecular Formula: | C26 H33 F N4 O2 S |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C)C(NCCCN2CCN(CC2)c2ccccc2F)=NS1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5737 |
| logD: | 4.4472 |
| logSw: | -4.1069 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.95 |
| InChI Key: | WBJODSQIVOUFBV-UHFFFAOYSA-N |