N-benzyl-1-[3-(4-methoxyphenyl)propanoyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-[3-(4-methoxyphenyl)propanoyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-[3-(4-methoxyphenyl)propanoyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0742 |
| Compound Name: | N-benzyl-1-[3-(4-methoxyphenyl)propanoyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 465.59 |
| Molecular Formula: | C27 H35 N3 O4 |
| Smiles: | COc1ccc(CCC(N2CCCC(CCNC(CC2)=O)C(NCc2ccccc2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5535 |
| logD: | 1.5535 |
| logSw: | -1.8719 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.671 |
| InChI Key: | CAIBQRCFNGIHNX-QHCPKHFHSA-N |