ethyl 3-{[4-(ethoxycarbonyl)piperidine-1-carbothioyl]amino}-5-methoxy-1H-indole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-{[4-(ethoxycarbonyl)piperidine-1-carbothioyl]amino}-5-methoxy-1H-indole-2-carboxylate
ethyl 3-{[4-(ethoxycarbonyl)piperidine-1-carbothioyl]amino}-5-methoxy-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C200-2539 |
| Compound Name: | ethyl 3-{[4-(ethoxycarbonyl)piperidine-1-carbothioyl]amino}-5-methoxy-1H-indole-2-carboxylate |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C21 H27 N3 O5 S |
| Smiles: | CCOC(C1CCN(CC1)C(Nc1c2cc(ccc2[nH]c1C(=O)OCC)OC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1445 |
| logD: | 3.1444 |
| logSw: | -3.3105 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.912 |
| InChI Key: | ZFTGVWFRXHWDKI-UHFFFAOYSA-N |