7-phenyl-1-{[1-(propan-2-yl)-1H-indol-3-yl]methyl}-8-[(pyridin-4-yl)methyl]-1,4,8-triazacycloundecan-5-one
Chemical Structure Depiction of
7-phenyl-1-{[1-(propan-2-yl)-1H-indol-3-yl]methyl}-8-[(pyridin-4-yl)methyl]-1,4,8-triazacycloundecan-5-one
7-phenyl-1-{[1-(propan-2-yl)-1H-indol-3-yl]methyl}-8-[(pyridin-4-yl)methyl]-1,4,8-triazacycloundecan-5-one
Compound characteristics
| Compound ID: | S791-0789 |
| Compound Name: | 7-phenyl-1-{[1-(propan-2-yl)-1H-indol-3-yl]methyl}-8-[(pyridin-4-yl)methyl]-1,4,8-triazacycloundecan-5-one |
| Molecular Weight: | 509.7 |
| Molecular Formula: | C32 H39 N5 O |
| Smiles: | CC(C)n1cc(CN2CCCN(Cc3ccncc3)C(CC(NCC2)=O)c2ccccc2)c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7265 |
| logD: | 0.3964 |
| logSw: | -3.7771 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.677 |
| InChI Key: | CKUKQQNJIARHJA-HKBQPEDESA-N |