2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0113 |
| Compound Name: | 2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 369.46 |
| Molecular Formula: | C21 H27 N3 O3 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(Cc1c(C(O)=O)c(C)cn1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9888 |
| logD: | 1.1896 |
| logSw: | -2.9141 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.294 |
| InChI Key: | DYCNBOHUKZUMTJ-UHFFFAOYSA-N |