benzyl 5-[(acetyloxy)methyl]-4-(3-methoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
benzyl 5-[(acetyloxy)methyl]-4-(3-methoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylate
benzyl 5-[(acetyloxy)methyl]-4-(3-methoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | 8009-1561 |
| Compound Name: | benzyl 5-[(acetyloxy)methyl]-4-(3-methoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 373.4 |
| Molecular Formula: | C20 H23 N O6 |
| Smiles: | CC(=O)OCc1c(CCC(=O)OC)c(C)c(C(=O)OCc2ccccc2)[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.8786 |
| logD: | 2.8786 |
| logSw: | -3.2617 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.576 |
| InChI Key: | WTRXRMOVEGCOPF-UHFFFAOYSA-N |