methyl 3-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}thiophene-2-carboxylate
methyl 3-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | C200-1793 |
| Compound Name: | methyl 3-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}thiophene-2-carboxylate |
| Molecular Weight: | 379.45 |
| Molecular Formula: | C16 H17 N3 O4 S2 |
| Smiles: | COC(c1c(ccs1)NC(N1CCN(CC1)C(c1ccco1)=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1963 |
| logD: | 2.1961 |
| logSw: | -2.6978 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.666 |
| InChI Key: | PCSAPUIRJMDSTP-UHFFFAOYSA-N |