ethyl 4-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0002 |
| Compound Name: | ethyl 4-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 417.93 |
| Molecular Formula: | C22 H28 Cl N3 O3 |
| Smiles: | CCOC(c1c(C)c(CCC(N2CCN(CC2)c2ccc(cc2)[Cl])=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.909 |
| logD: | 3.9089 |
| logSw: | -4.3112 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.355 |
| InChI Key: | HJAZKIICEKYBHH-UHFFFAOYSA-N |