ethyl 1-{3-[(1-benzylpiperidin-4-yl)amino]-3-oxopropyl}-5-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[(1-benzylpiperidin-4-yl)amino]-3-oxopropyl}-5-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate
ethyl 1-{3-[(1-benzylpiperidin-4-yl)amino]-3-oxopropyl}-5-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-1736 |
| Compound Name: | ethyl 1-{3-[(1-benzylpiperidin-4-yl)amino]-3-oxopropyl}-5-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 503.64 |
| Molecular Formula: | C30 H37 N3 O4 |
| Smiles: | CCOC(c1cc(c2ccc(cc2)OC)n(CCC(NC2CCN(CC2)Cc2ccccc2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9084 |
| logD: | 3.3507 |
| logSw: | -4.5275 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.931 |
| InChI Key: | PTASUJNJZJOLMA-UHFFFAOYSA-N |