ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(6-methoxy-6-oxohexanamido)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(6-methoxy-6-oxohexanamido)-1H-pyrrole-2-carboxylate
ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(6-methoxy-6-oxohexanamido)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V015-3452 |
| Compound Name: | ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(6-methoxy-6-oxohexanamido)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 522.6 |
| Molecular Formula: | C29 H34 N2 O7 |
| Smiles: | CCOC(c1c(c(cn1Cc1ccccc1)c1ccc(c(c1)OC)OC)NC(CCCCC(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3274 |
| logD: | 3.2198 |
| logSw: | -3.4651 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.572 |
| InChI Key: | WPAAAFPUGWIJKJ-UHFFFAOYSA-N |