N-benzyl-1-(oxan-4-yl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(oxan-4-yl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-(oxan-4-yl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0942 |
| Compound Name: | N-benzyl-1-(oxan-4-yl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 387.52 |
| Molecular Formula: | C22 H33 N3 O3 |
| Smiles: | C1CC(CCNC(CCN(C1)C1CCOCC1)=O)C(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4298 |
| logD: | -1.128 |
| logSw: | -1.64 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.2 |
| InChI Key: | FRLBITGKEAENKT-IBGZPJMESA-N |