5'-[(5-fluoro-2-methylbenzene-1-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5'-[(5-fluoro-2-methylbenzene-1-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1)
5'-[(5-fluoro-2-methylbenzene-1-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0949 |
| Compound Name: | 5'-[(5-fluoro-2-methylbenzene-1-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 595.57 |
| Molecular Formula: | C25 H24 F N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccccc1C1CCN(CC=1)c1c(cc(cn1)NS(c1cc(ccc1C)F)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3605 |
| logD: | 4.0296 |
| logSw: | -4.9938 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.548 |
| InChI Key: | XLMCVDGVISUKEA-UHFFFAOYSA-N |