2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0379 |
| Compound Name: | 2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C22 H29 N3 O3 |
| Smiles: | CCn1cc(C)c(C(O)=O)c1CC(N1CCN(CC1)c1cccc(C)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3025 |
| logD: | 1.5033 |
| logSw: | -3.2733 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.463 |
| InChI Key: | TVRJKVCVDJQBCM-UHFFFAOYSA-N |