ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(4-fluorobenzamido)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(4-fluorobenzamido)-1H-pyrrole-2-carboxylate
ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(4-fluorobenzamido)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V015-3450 |
| Compound Name: | ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(4-fluorobenzamido)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 502.54 |
| Molecular Formula: | C29 H27 F N2 O5 |
| Smiles: | CCOC(c1c(c(cn1Cc1ccccc1)c1ccc(c(c1)OC)OC)NC(c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5385 |
| logD: | 3.6005 |
| logSw: | -4.2138 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.935 |
| InChI Key: | UYXQADAXRSSOBE-UHFFFAOYSA-N |