ethyl 4-({[3-(4-ethylpiperazin-1-yl)propyl][(furan-2-yl)methyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[3-(4-ethylpiperazin-1-yl)propyl][(furan-2-yl)methyl]carbamothioyl}amino)benzoate
ethyl 4-({[3-(4-ethylpiperazin-1-yl)propyl][(furan-2-yl)methyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | C087-0132 |
| Compound Name: | ethyl 4-({[3-(4-ethylpiperazin-1-yl)propyl][(furan-2-yl)methyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 458.62 |
| Molecular Formula: | C24 H34 N4 O3 S |
| Smiles: | CCN1CCN(CCCN(Cc2ccco2)C(Nc2ccc(cc2)C(=O)OCC)=S)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.991 |
| logD: | 3.0428 |
| logSw: | -3.7975 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.428 |
| InChI Key: | SAXVIASCAYTMHQ-UHFFFAOYSA-N |