ethyl 3-[2-(acetyloxy)-2-methylpropanamido]-1-benzyl-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[2-(acetyloxy)-2-methylpropanamido]-1-benzyl-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate
ethyl 3-[2-(acetyloxy)-2-methylpropanamido]-1-benzyl-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V017-1223 |
| Compound Name: | ethyl 3-[2-(acetyloxy)-2-methylpropanamido]-1-benzyl-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C27 H30 N2 O6 |
| Smiles: | CCOC(c1c(c(cn1Cc1ccccc1)c1ccc(cc1)OC)NC(C(C)(C)OC(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7282 |
| logD: | 3.6623 |
| logSw: | -3.8463 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.441 |
| InChI Key: | ZSVOJRNWAKDDPS-UHFFFAOYSA-N |