2-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0110 |
| Compound Name: | 2-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 389.88 |
| Molecular Formula: | C20 H24 Cl N3 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(Cc1c(C(O)=O)c(C)cn1C)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1479 |
| logD: | 1.3487 |
| logSw: | -3.2918 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.294 |
| InChI Key: | UTDRQFVTFPFSNO-UHFFFAOYSA-N |