5-benzamido-2-[4-(2-methylphenyl)-3,6-dihydropyridin-1(2H)-yl]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-benzamido-2-[4-(2-methylphenyl)-3,6-dihydropyridin-1(2H)-yl]benzoic acid--trifluoroacetic acid (1/1)
5-benzamido-2-[4-(2-methylphenyl)-3,6-dihydropyridin-1(2H)-yl]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-1214 |
| Compound Name: | 5-benzamido-2-[4-(2-methylphenyl)-3,6-dihydropyridin-1(2H)-yl]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 526.51 |
| Molecular Formula: | C26 H24 N2 O3 |
| Salt: | CF3COOH |
| Smiles: | Cc1ccccc1C1CCN(CC=1)c1ccc(cc1C(O)=O)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3122 |
| logD: | 3.346 |
| logSw: | -5.1388 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.618 |
| InChI Key: | WIKPVINCZBYUDS-UHFFFAOYSA-N |