N-benzyl-N-ethyl-4-oxo-1-(pyridine-3-carbonyl)-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-N-ethyl-4-oxo-1-(pyridine-3-carbonyl)-1,5-diazacycloundecane-8-carboxamide
N-benzyl-N-ethyl-4-oxo-1-(pyridine-3-carbonyl)-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-2344 |
| Compound Name: | N-benzyl-N-ethyl-4-oxo-1-(pyridine-3-carbonyl)-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C25 H32 N4 O3 |
| Smiles: | CCN(Cc1ccccc1)C(C1CCCN(CCC(NCC1)=O)C(c1cccnc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5235 |
| logD: | 0.5235 |
| logSw: | -1.2096 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.695 |
| InChI Key: | PMMLSBIIXVNRSL-NRFANRHFSA-N |