ethyl 3-[(ethoxycarbonyl)amino]-5-fluoro-1H-indole-2-carboxylate--hydrogen iodide (1/1)
Chemical Structure Depiction of
ethyl 3-[(ethoxycarbonyl)amino]-5-fluoro-1H-indole-2-carboxylate--hydrogen iodide (1/1)
ethyl 3-[(ethoxycarbonyl)amino]-5-fluoro-1H-indole-2-carboxylate--hydrogen iodide (1/1)
Compound characteristics
Compound ID: | 4138-0142 |
Compound Name: | ethyl 3-[(ethoxycarbonyl)amino]-5-fluoro-1H-indole-2-carboxylate--hydrogen iodide (1/1) |
Molecular Weight: | 422.19 |
Molecular Formula: | C14 H15 F N2 O4 |
Salt: | HI |
Smiles: | CCOC(c1c(c2cc(ccc2[nH]1)F)NC(=O)OCC)=O |
Stereo: | ACHIRAL |
logP: | 2.1719 |
logD: | 1.9797 |
logSw: | -2.8508 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 61.16 |
InChI Key: | QQRGCZVKCATDDI-UHFFFAOYSA-N |