5-(2-methylbenzamido)-2-(4-phenylpiperazin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-(2-methylbenzamido)-2-(4-phenylpiperazin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
5-(2-methylbenzamido)-2-(4-phenylpiperazin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-0389 |
| Compound Name: | 5-(2-methylbenzamido)-2-(4-phenylpiperazin-1-yl)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 529.52 |
| Molecular Formula: | C25 H25 N3 O3 |
| Salt: | CF3COOH |
| Smiles: | Cc1ccccc1C(Nc1ccc(c(c1)C(O)=O)N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.708 |
| logD: | 2.4573 |
| logSw: | -4.2353 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.15 |
| InChI Key: | CDTCQHRVQSZBRB-UHFFFAOYSA-N |