4-oxo-N-[(pyridin-2-yl)methyl]-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
4-oxo-N-[(pyridin-2-yl)methyl]-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
4-oxo-N-[(pyridin-2-yl)methyl]-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0293 |
| Compound Name: | 4-oxo-N-[(pyridin-2-yl)methyl]-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C22 H29 N5 O2 |
| Smiles: | C1CC(CCNC(CCN(C1)Cc1ccncc1)=O)C(NCc1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.6207 |
| logD: | -0.6889 |
| logSw: | -1.1778 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.71 |
| InChI Key: | JRDRESRUJCGDJO-IBGZPJMESA-N |