ethyl 4-[({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}carbamothioyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}carbamothioyl)amino]benzoate
ethyl 4-[({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}carbamothioyl)amino]benzoate
Compound characteristics
| Compound ID: | C270-0183 |
| Compound Name: | ethyl 4-[({3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}carbamothioyl)amino]benzoate |
| Molecular Weight: | 444.57 |
| Molecular Formula: | C23 H29 F N4 O2 S |
| Smiles: | CCOC(c1ccc(cc1)NC(NCCCN1CCN(CC1)c1ccccc1F)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0411 |
| logD: | 3.8077 |
| logSw: | -3.8941 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.92 |
| InChI Key: | GTOSEGLSLUGYLX-UHFFFAOYSA-N |