ethyl 4-({[3-(piperazin-1-yl)propyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[3-(piperazin-1-yl)propyl]carbamothioyl}amino)benzoate
ethyl 4-({[3-(piperazin-1-yl)propyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | 8016-1528 |
| Compound Name: | ethyl 4-({[3-(piperazin-1-yl)propyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 350.48 |
| Molecular Formula: | C17 H26 N4 O2 S |
| Smiles: | CCOC(c1ccc(cc1)NC(NCCCN1CCNCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9041 |
| logD: | 0.2773 |
| logSw: | -2.4584 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 56.921 |
| InChI Key: | ULJUCAJAAGVESL-UHFFFAOYSA-N |