N-benzyl-1-[(3-methoxyphenyl)methyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-[(3-methoxyphenyl)methyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-[(3-methoxyphenyl)methyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0870 |
| Compound Name: | N-benzyl-1-[(3-methoxyphenyl)methyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 423.56 |
| Molecular Formula: | C25 H33 N3 O3 |
| Smiles: | COc1cccc(CN2CCCC(CCNC(CC2)=O)C(NCc2ccccc2)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.701 |
| logD: | -0.037 |
| logSw: | -2.2461 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.283 |
| InChI Key: | HASYOYQKWIGNGZ-QFIPXVFZSA-N |