ethyl 5-(3-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-3-oxopropyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(3-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-3-oxopropyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-(3-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-3-oxopropyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G726-1279 |
| Compound Name: | ethyl 5-(3-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-3-oxopropyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 454.61 |
| Molecular Formula: | C26 H38 N4 O3 |
| Smiles: | CCOC(c1c(C)c(CCC(NCCCN2CCN(CC2)Cc2ccccc2)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0813 |
| logD: | 1.2617 |
| logSw: | -2.5674 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.033 |
| InChI Key: | NMWSUQXIXYMYFR-UHFFFAOYSA-N |