4-(2-methylphenyl)-5'-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid
Chemical Structure Depiction of
4-(2-methylphenyl)-5'-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid
4-(2-methylphenyl)-5'-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid
Compound characteristics
| Compound ID: | F293-0943 |
| Compound Name: | 4-(2-methylphenyl)-5'-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}-3,6-dihydro-2H-[1,2'-bipyridine]-3'-carboxylic acid |
| Molecular Weight: | 605.63 |
| Molecular Formula: | C27 H29 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)c1ccc(cc1)S(Nc1cc(C(O)=O)c(nc1)N1CCC(=CC1)c1ccccc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2961 |
| logD: | 4.9653 |
| logSw: | -5.2105 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.548 |
| InChI Key: | QBPSQOOZNDJASU-UHFFFAOYSA-N |