3-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
3-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F915-0017 |
| Compound Name: | 3-bromo-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 565.39 |
| Molecular Formula: | C20 H27 Br N4 O3 |
| Salt: | CF3COOH |
| Smiles: | C1CC(N(C1)CCCN(CC(N1CCNCC1)=O)C(c1cccc(c1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0962 |
| logD: | -0.6557 |
| logSw: | -1.8687 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.022 |
| InChI Key: | HIKCFGCFKLKPMT-UHFFFAOYSA-N |