N-[(2-methoxyphenyl)methyl]-4-oxo-1-[(pyridin-3-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-[(2-methoxyphenyl)methyl]-4-oxo-1-[(pyridin-3-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
N-[(2-methoxyphenyl)methyl]-4-oxo-1-[(pyridin-3-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0468 |
| Compound Name: | N-[(2-methoxyphenyl)methyl]-4-oxo-1-[(pyridin-3-yl)methyl]-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C24 H32 N4 O3 |
| Smiles: | COc1ccccc1CNC(C1CCCN(CCC(NCC1)=O)Cc1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5538 |
| logD: | 0.3963 |
| logSw: | -1.183 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.887 |
| InChI Key: | HHNOQCXPVCWNDF-FQEVSTJZSA-N |