4-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
4-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F292-0450 |
| Compound Name: | 4-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[(thiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 587.59 |
| Molecular Formula: | C22 H23 N3 O5 S2 |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)c1ccc(cc1NS(c1cccs1)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4575 |
| logD: | 2.5196 |
| logSw: | -4.1534 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.572 |
| InChI Key: | NZZYBQILCRZAKH-UHFFFAOYSA-N |