N-benzyl-4-oxo-1-(quinoline-2-carbonyl)-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-4-oxo-1-(quinoline-2-carbonyl)-1,5-diazacycloundecane-8-carboxamide
N-benzyl-4-oxo-1-(quinoline-2-carbonyl)-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0744 |
| Compound Name: | N-benzyl-4-oxo-1-(quinoline-2-carbonyl)-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Smiles: | C1CC(CCNC(CCN(C1)C(c1ccc2ccccc2n1)=O)=O)C(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7018 |
| logD: | 1.7018 |
| logSw: | -2.3086 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.985 |
| InChI Key: | PTNKNSRILPEDIZ-QFIPXVFZSA-N |