5'-[(5-chlorothiophene-2-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-chlorothiophene-2-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1)
5'-[(5-chlorothiophene-2-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F293-0940 |
| Compound Name: | 5'-[(5-chlorothiophene-2-sulfonyl)amino]-4-(2-methylphenyl)-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 604.02 |
| Molecular Formula: | C22 H20 Cl N3 O4 S2 |
| Salt: | CF3COOH |
| Smiles: | Cc1ccccc1C1CCN(CC=1)c1c(cc(cn1)NS(c1ccc(s1)[Cl])(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4962 |
| logD: | 4.1654 |
| logSw: | -5.5111 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.566 |
| InChI Key: | VPISSNJUYCOKBP-UHFFFAOYSA-N |