ethyl 2-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}benzoate
ethyl 2-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}benzoate
Compound characteristics
| Compound ID: | C200-1856 |
| Compound Name: | ethyl 2-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}benzoate |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C19 H21 N3 O4 S |
| Smiles: | CCOC(c1ccccc1NC(N1CCN(CC1)C(c1ccco1)=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0461 |
| logD: | 3.046 |
| logSw: | -3.4819 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.227 |
| InChI Key: | XNJCDJLFZAXYGZ-UHFFFAOYSA-N |