ethyl 3-[2-(acetyloxy)-2-methylpropanamido]-1-benzyl-4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[2-(acetyloxy)-2-methylpropanamido]-1-benzyl-4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylate
ethyl 3-[2-(acetyloxy)-2-methylpropanamido]-1-benzyl-4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V016-6174 |
| Compound Name: | ethyl 3-[2-(acetyloxy)-2-methylpropanamido]-1-benzyl-4-(3,4-dimethoxyphenyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 508.57 |
| Molecular Formula: | C28 H32 N2 O7 |
| Smiles: | CCOC(c1c(c(cn1Cc1ccccc1)c1ccc(c(c1)OC)OC)NC(C(C)(C)OC(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3082 |
| logD: | 3.2742 |
| logSw: | -3.5498 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.158 |
| InChI Key: | MSPLUXXWPKZRTH-UHFFFAOYSA-N |