4-methoxy-N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-methoxy-N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
4-methoxy-N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0328 |
| Compound Name: | 4-methoxy-N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 545.58 |
| Molecular Formula: | C22 H29 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1)C(N(CCc1ccccc1)CCS(N1CCNCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3562 |
| logD: | 1.0115 |
| logSw: | -2.1631 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.516 |
| InChI Key: | VKEREHDPVXAGPZ-UHFFFAOYSA-N |