ethyl 4-(3-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-3-oxopropyl)-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-3-oxopropyl)-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
ethyl 4-(3-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-3-oxopropyl)-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0820 |
| Compound Name: | ethyl 4-(3-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-3-oxopropyl)-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 454.61 |
| Molecular Formula: | C26 H38 N4 O3 |
| Smiles: | CCOC(c1c(C)c(CCC(NCCN2CCN(CC2)Cc2ccccc2)=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0796 |
| logD: | 1.8629 |
| logSw: | -2.5572 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.365 |
| InChI Key: | BJNCDVRMHFLSSS-UHFFFAOYSA-N |