N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0324 |
| Compound Name: | N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 515.55 |
| Molecular Formula: | C21 H27 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | C(CN(CCS(N1CCNCC1)(=O)=O)C(c1ccccc1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.2687 |
| logD: | 0.9241 |
| logSw: | -2.0794 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.972 |
| InChI Key: | KIZPUNLJJFFAHX-UHFFFAOYSA-N |