2-([1,4'-bipiperidin]-1'-yl)-5-[(5-chlorothiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-([1,4'-bipiperidin]-1'-yl)-5-[(5-chlorothiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
2-([1,4'-bipiperidin]-1'-yl)-5-[(5-chlorothiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0606 |
| Compound Name: | 2-([1,4'-bipiperidin]-1'-yl)-5-[(5-chlorothiophene-2-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 598.06 |
| Molecular Formula: | C21 H26 Cl N3 O4 S2 |
| Salt: | CF3COOH |
| Smiles: | C1CCN(CC1)C1CCN(CC1)c1ccc(cc1C(O)=O)NS(c1ccc(s1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6527 |
| logD: | 4.6527 |
| logSw: | -4.4154 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.56 |
| InChI Key: | ZCDVQJWPQNBHAG-UHFFFAOYSA-N |