1,4-dimethyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1,4-dimethyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrrole-3-carboxylic acid
1,4-dimethyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0033 |
| Compound Name: | 1,4-dimethyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 279.34 |
| Molecular Formula: | C14 H21 N3 O3 |
| Smiles: | Cc1cn(C)c(CC(N2CCN(C)CC2)=O)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.048 |
| logD: | -1.7512 |
| logSw: | -0.2296 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.811 |
| InChI Key: | ISXXZFLIRVHGSC-UHFFFAOYSA-N |