2-methoxy-N-(3-methylbutyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-methoxy-N-(3-methylbutyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
2-methoxy-N-(3-methylbutyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0297 |
| Compound Name: | 2-methoxy-N-(3-methylbutyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 511.56 |
| Molecular Formula: | C19 H31 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)CCN(CCS(N1CCNCC1)(=O)=O)C(c1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2613 |
| logD: | 0.9166 |
| logSw: | -2.3211 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.874 |
| InChI Key: | FGAFNDABHDLUQJ-UHFFFAOYSA-N |