ethyl 4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E137-0091 |
| Compound Name: | ethyl 4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C22 H29 N3 O3 |
| Smiles: | CCOC(c1c(C)c(C(N2CCN(CC2)c2cccc(C)c2C)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0234 |
| logD: | 4.0234 |
| logSw: | -4.1236 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.581 |
| InChI Key: | LCDZVNRCNDLJPR-UHFFFAOYSA-N |