5'-[(3,4-difluorobenzene-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'-[(3,4-difluorobenzene-1-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1)
5'-[(3,4-difluorobenzene-1-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0951 |
| Compound Name: | 5'-[(3,4-difluorobenzene-1-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 599.53 |
| Molecular Formula: | C24 H21 F2 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccccc1C1CCN(CC=1)c1c(cc(cn1)NS(c1ccc(c(c1)F)F)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2248 |
| logD: | 3.8939 |
| logSw: | -4.6337 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.548 |
| InChI Key: | KISYIPMLPUXCSL-UHFFFAOYSA-N |