N-[2-(1H-indol-3-yl)ethyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
N-[2-(1H-indol-3-yl)ethyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0336 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C26 H33 N5 O2 |
| Smiles: | C1CC(CCNC(CCN(C1)Cc1ccncc1)=O)C(NCCc1c[nH]c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8139 |
| logD: | 0.7457 |
| logSw: | -1.6359 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.879 |
| InChI Key: | IWEUONHEITYYRZ-NRFANRHFSA-N |