1-[(5-methoxy-1-methyl-1H-indol-3-yl)methyl]-7-phenyl-8-[(pyridin-4-yl)methyl]-1,4,8-triazacycloundecan-5-one
Chemical Structure Depiction of
1-[(5-methoxy-1-methyl-1H-indol-3-yl)methyl]-7-phenyl-8-[(pyridin-4-yl)methyl]-1,4,8-triazacycloundecan-5-one
1-[(5-methoxy-1-methyl-1H-indol-3-yl)methyl]-7-phenyl-8-[(pyridin-4-yl)methyl]-1,4,8-triazacycloundecan-5-one
Compound characteristics
| Compound ID: | S791-0790 |
| Compound Name: | 1-[(5-methoxy-1-methyl-1H-indol-3-yl)methyl]-7-phenyl-8-[(pyridin-4-yl)methyl]-1,4,8-triazacycloundecan-5-one |
| Molecular Weight: | 511.67 |
| Molecular Formula: | C31 H37 N5 O2 |
| Smiles: | Cn1cc(CN2CCCN(Cc3ccncc3)C(CC(NCC2)=O)c2ccccc2)c2cc(ccc12)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.965 |
| logD: | 1.3198 |
| logSw: | -3.0788 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.986 |
| InChI Key: | MICZHRSLYSDTIP-PMERELPUSA-N |