2-[butyl(methyl)amino]-5-(2-methylbenzamido)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-[butyl(methyl)amino]-5-(2-methylbenzamido)benzoic acid--trifluoroacetic acid (1/1)
2-[butyl(methyl)amino]-5-(2-methylbenzamido)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-0084 |
| Compound Name: | 2-[butyl(methyl)amino]-5-(2-methylbenzamido)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 454.44 |
| Molecular Formula: | C20 H24 N2 O3 |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)c1ccc(cc1C(O)=O)NC(c1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1323 |
| logD: | 1.8816 |
| logSw: | -3.9474 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.641 |
| InChI Key: | MAKDARZOTOZTNE-UHFFFAOYSA-N |