3-[([(3-methoxypropyl)amino]{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[([(3-methoxypropyl)amino]{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
3-[([(3-methoxypropyl)amino]{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G696-5792 |
| Compound Name: | 3-[([(3-methoxypropyl)amino]{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}methylidene)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 561.56 |
| Molecular Formula: | C22 H33 N5 O5 |
| Salt: | CF3COOH |
| Smiles: | COCCCN\C(=N/c1cccc(c1)C(O)=O)N1CCN(CC1)CC(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.723 |
| logD: | 0.723 |
| logSw: | -1.7858 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.992 |
| InChI Key: | NHPROJQWDKCDHG-UHFFFAOYSA-N |