2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}-5-[(thiophene-2-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}-5-[(thiophene-2-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}-5-[(thiophene-2-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0964 |
| Compound Name: | 2-{4-[2-(piperidin-1-yl)ethyl]piperidin-1-yl}-5-[(thiophene-2-sulfonyl)amino]pyridine-3-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 592.66 |
| Molecular Formula: | C22 H30 N4 O4 S2 |
| Salt: | CF3COOH |
| Smiles: | C1CCN(CC1)CCC1CCN(CC1)c1c(cc(cn1)NS(c1cccs1)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2495 |
| logD: | 4.2495 |
| logSw: | -3.9342 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.548 |
| InChI Key: | WLCCMWRFPZXPES-UHFFFAOYSA-N |