2-(2-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-2-oxoethyl)-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-(2-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-2-oxoethyl)-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
2-(2-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-2-oxoethyl)-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0402 |
| Compound Name: | 2-(2-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-2-oxoethyl)-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 426.56 |
| Molecular Formula: | C24 H34 N4 O3 |
| Smiles: | CCn1cc(C)c(C(O)=O)c1CC(NCCCN1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3285 |
| logD: | 1.3285 |
| logSw: | -1.7991 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.947 |
| InChI Key: | NOKXNXUTLHWYOP-UHFFFAOYSA-N |