N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0334 |
| Compound Name: | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 477.61 |
| Molecular Formula: | C27 H35 N5 O3 |
| Smiles: | COc1ccc2c(c1)c(CCNC(C1CCCN(CCC(NCC1)=O)Cc1ccncc1)=O)c[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8327 |
| logD: | 0.7645 |
| logSw: | -1.6744 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.423 |
| InChI Key: | ORAVYRZHIKCSEX-NRFANRHFSA-N |