ethyl 4-({[(furan-2-yl)methyl][2-(piperidin-1-yl)ethyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[(furan-2-yl)methyl][2-(piperidin-1-yl)ethyl]carbamothioyl}amino)benzoate
ethyl 4-({[(furan-2-yl)methyl][2-(piperidin-1-yl)ethyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | C087-0135 |
| Compound Name: | ethyl 4-({[(furan-2-yl)methyl][2-(piperidin-1-yl)ethyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 415.55 |
| Molecular Formula: | C22 H29 N3 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N(CCN1CCCCC1)Cc1ccco1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5658 |
| logD: | 1.7152 |
| logSw: | -3.9993 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.891 |
| InChI Key: | GFMPGTCADSXCAL-UHFFFAOYSA-N |