ethyl 3-{[butyl(methyl)carbamothioyl]amino}-5-methoxy-1H-indole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-{[butyl(methyl)carbamothioyl]amino}-5-methoxy-1H-indole-2-carboxylate
ethyl 3-{[butyl(methyl)carbamothioyl]amino}-5-methoxy-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C200-2505 |
| Compound Name: | ethyl 3-{[butyl(methyl)carbamothioyl]amino}-5-methoxy-1H-indole-2-carboxylate |
| Molecular Weight: | 363.48 |
| Molecular Formula: | C18 H25 N3 O3 S |
| Smiles: | CCCCN(C)C(Nc1c2cc(ccc2[nH]c1C(=O)OCC)OC)=S |
| Stereo: | ACHIRAL |
| logP: | 3.3125 |
| logD: | 3.3124 |
| logSw: | -3.6228 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.91 |
| InChI Key: | OBQFJVFXUOIQFC-UHFFFAOYSA-N |