4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F292-0260 |
| Compound Name: | 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 585.62 |
| Molecular Formula: | C23 H25 N3 O4 S2 |
| Salt: | CF3COOH |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)c1ccc(cc1NS(c1cccs1)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4772 |
| logD: | 3.5393 |
| logSw: | -5.2052 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.728 |
| InChI Key: | UEEYBUSQWNMYNL-UHFFFAOYSA-N |