N-benzyl-1-(furan-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(furan-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-(furan-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0712 |
| Compound Name: | N-benzyl-1-(furan-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 397.47 |
| Molecular Formula: | C22 H27 N3 O4 |
| Smiles: | C1CC(CCNC(CCN(C1)C(c1ccoc1)=O)=O)C(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3171 |
| logD: | 0.3171 |
| logSw: | -1.5816 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.458 |
| InChI Key: | WAQVPWLKYMVMAB-SFHVURJKSA-N |