1-[(5-methylfuran-2-yl)methyl]-4-oxo-N-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-[(5-methylfuran-2-yl)methyl]-4-oxo-N-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
1-[(5-methylfuran-2-yl)methyl]-4-oxo-N-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1150 |
| Compound Name: | 1-[(5-methylfuran-2-yl)methyl]-4-oxo-N-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C22 H30 N4 O3 |
| Smiles: | Cc1ccc(CN2CCCC(CCNC(CC2)=O)C(NCc2ccncc2)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.0481 |
| logD: | -0.8179 |
| logSw: | -1.2267 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.43 |
| InChI Key: | MBLOZFAXGXGVKC-IBGZPJMESA-N |