N-benzyl-1-[3-(1H-indol-3-yl)propanoyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-[3-(1H-indol-3-yl)propanoyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-[3-(1H-indol-3-yl)propanoyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0739 |
| Compound Name: | N-benzyl-1-[3-(1H-indol-3-yl)propanoyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 474.6 |
| Molecular Formula: | C28 H34 N4 O3 |
| Smiles: | C1CC(CCNC(CCN(C1)C(CCc1c[nH]c2ccccc12)=O)=O)C(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6246 |
| logD: | 1.6246 |
| logSw: | -1.9149 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.998 |
| InChI Key: | NHMIBQHCYJLNMG-QFIPXVFZSA-N |