4-(2-hydroxyanilino)-4-oxo-2-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}methyl)butanoic acid
Chemical Structure Depiction of
4-(2-hydroxyanilino)-4-oxo-2-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}methyl)butanoic acid
4-(2-hydroxyanilino)-4-oxo-2-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}methyl)butanoic acid
Compound characteristics
| Compound ID: | IB05-8090 |
| Compound Name: | 4-(2-hydroxyanilino)-4-oxo-2-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}methyl)butanoic acid |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C21 H30 N4 O5 |
| Smiles: | C1CCN(C1)C(CN1CCN(CC1)CC(CC(Nc1ccccc1O)=O)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.37 |
| logD: | -3.08 |
| logSw: | -1.89 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 172.67 |
| InChI Key: | LRITTWKRUHKFKL-INIZCTEOSA-N |