N-benzyl-1-(4-methylpyridine-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(4-methylpyridine-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-(4-methylpyridine-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0766 |
| Compound Name: | N-benzyl-1-(4-methylpyridine-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 422.53 |
| Molecular Formula: | C24 H30 N4 O3 |
| Smiles: | Cc1ccncc1C(N1CCCC(CCNC(CC1)=O)C(NCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4479 |
| logD: | 0.4473 |
| logSw: | -1.4904 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.173 |
| InChI Key: | PTNVPPXZZNLAOZ-FQEVSTJZSA-N |