ethyl 3,5-dimethyl-4-[3-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-[3-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-[3-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0466 |
| Compound Name: | ethyl 3,5-dimethyl-4-[3-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}piperidin-1-yl)-3-oxopropyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 489.66 |
| Molecular Formula: | C26 H43 N5 O4 |
| Smiles: | CCOC(c1c(C)c(CCC(N2CCC(CC2)C(NCCCN2CCN(C)CC2)=O)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9105 |
| logD: | -0.294 |
| logSw: | -1.195 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.809 |
| InChI Key: | NFRFWVJSMPQOEN-UHFFFAOYSA-N |