3-[(3-fluorobenzene-1-sulfonyl)amino]-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(3-fluorobenzene-1-sulfonyl)amino]-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
3-[(3-fluorobenzene-1-sulfonyl)amino]-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F292-0313 |
| Compound Name: | 3-[(3-fluorobenzene-1-sulfonyl)amino]-4-[4-(pyridin-2-yl)piperazin-1-yl]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 570.52 |
| Molecular Formula: | C22 H21 F N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | C1CN(CCN1c1ccc(cc1NS(c1cccc(c1)F)(=O)=O)C(O)=O)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 4.2515 |
| logD: | 1.5127 |
| logSw: | -4.2636 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.521 |
| InChI Key: | ZFCLUIXJRCPLRL-UHFFFAOYSA-N |