2-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0112 |
| Compound Name: | 2-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 347.46 |
| Molecular Formula: | C19 H29 N3 O3 |
| Smiles: | Cc1cn(C)c(CC(N2CCN(CC2)C2CCCCC2)=O)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8871 |
| logD: | 0.0879 |
| logSw: | -1.8074 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.428 |
| InChI Key: | PECCFSIHDOTULI-UHFFFAOYSA-N |