ethyl 2-{[4-(4-fluorophenyl)piperazine-1-carbothioyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[4-(4-fluorophenyl)piperazine-1-carbothioyl]amino}benzoate
ethyl 2-{[4-(4-fluorophenyl)piperazine-1-carbothioyl]amino}benzoate
Compound characteristics
| Compound ID: | C200-1852 |
| Compound Name: | ethyl 2-{[4-(4-fluorophenyl)piperazine-1-carbothioyl]amino}benzoate |
| Molecular Weight: | 387.47 |
| Molecular Formula: | C20 H22 F N3 O2 S |
| Smiles: | CCOC(c1ccccc1NC(N1CCN(CC1)c1ccc(cc1)F)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6238 |
| logD: | 4.6234 |
| logSw: | -4.2858 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.453 |
| InChI Key: | OGSURDKXMJDNGT-UHFFFAOYSA-N |