4-({[4-(2,3-dimethylphenyl)piperazin-1-yl][(3-ethoxypropyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-({[4-(2,3-dimethylphenyl)piperazin-1-yl][(3-ethoxypropyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
4-({[4-(2,3-dimethylphenyl)piperazin-1-yl][(3-ethoxypropyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G537-0153 |
| Compound Name: | 4-({[4-(2,3-dimethylphenyl)piperazin-1-yl][(3-ethoxypropyl)amino]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 552.59 |
| Molecular Formula: | C25 H34 N4 O3 |
| Salt: | CF3COOH |
| Smiles: | CCOCCCN/C(=N/c1ccc(cc1)C(O)=O)N1CCN(CC1)c1cccc(C)c1C |
| Stereo: | ACHIRAL |
| logP: | 4.8057 |
| logD: | 4.8057 |
| logSw: | -4.1815 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.744 |
| InChI Key: | IIYDXLHEJNAHKL-UHFFFAOYSA-N |