ethyl 4-{2-[2-(2-methylbenzoyl)-1H-pyrrol-1-yl]acetamido}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{2-[2-(2-methylbenzoyl)-1H-pyrrol-1-yl]acetamido}piperidine-1-carboxylate
ethyl 4-{2-[2-(2-methylbenzoyl)-1H-pyrrol-1-yl]acetamido}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C856-0594 |
| Compound Name: | ethyl 4-{2-[2-(2-methylbenzoyl)-1H-pyrrol-1-yl]acetamido}piperidine-1-carboxylate |
| Molecular Weight: | 397.47 |
| Molecular Formula: | C22 H27 N3 O4 |
| Smiles: | CCOC(N1CCC(CC1)NC(Cn1cccc1C(c1ccccc1C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1056 |
| logD: | 3.1056 |
| logSw: | -3.4468 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.272 |
| InChI Key: | YTUWZPXMRCIIDO-UHFFFAOYSA-N |