N-{[4-(morpholin-4-yl)phenyl]methyl}-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-{[4-(morpholin-4-yl)phenyl]methyl}-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
N-{[4-(morpholin-4-yl)phenyl]methyl}-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0426 |
| Compound Name: | N-{[4-(morpholin-4-yl)phenyl]methyl}-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 479.62 |
| Molecular Formula: | C27 H37 N5 O3 |
| Smiles: | C1CC(CCNC(CCN(C1)Cc1ccncc1)=O)C(NCc1ccc(cc1)N1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.0081 |
| logD: | -0.0601 |
| logSw: | -1.1978 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.528 |
| InChI Key: | BPRTUMSENAVAOX-DEOSSOPVSA-N |