4-methyl-N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-methyl-N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
4-methyl-N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0310 |
| Compound Name: | 4-methyl-N-(2-phenylethyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 529.58 |
| Molecular Formula: | C22 H29 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1)C(N(CCc1ccccc1)CCS(N1CCNCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7972 |
| logD: | 1.4525 |
| logSw: | -2.3227 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.972 |
| InChI Key: | RKGYSEXSDGFHPF-UHFFFAOYSA-N |