4-({[(3-ethoxypropyl)amino][4-(pyridin-2-yl)piperazin-1-yl]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-({[(3-ethoxypropyl)amino][4-(pyridin-2-yl)piperazin-1-yl]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
4-({[(3-ethoxypropyl)amino][4-(pyridin-2-yl)piperazin-1-yl]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G537-5826 |
| Compound Name: | 4-({[(3-ethoxypropyl)amino][4-(pyridin-2-yl)piperazin-1-yl]methylidene}amino)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 525.53 |
| Molecular Formula: | C22 H29 N5 O3 |
| Salt: | CF3COOH |
| Smiles: | CCOCCCN\C(=N/c1ccc(cc1)C(O)=O)N1CCN(CC1)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.3497 |
| logD: | 3.3497 |
| logSw: | -3.2723 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.557 |
| InChI Key: | LRANUWPRSIBWEA-UHFFFAOYSA-N |