3-[rel-(2R,6R)-2,8-dimethyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl]-N-[2-(1H-indol-3-yl)ethyl]benzamide
Chemical Structure Depiction of
3-[rel-(2R,6R)-2,8-dimethyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl]-N-[2-(1H-indol-3-yl)ethyl]benzamide
3-[rel-(2R,6R)-2,8-dimethyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl]-N-[2-(1H-indol-3-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | C326-0370 |
| Compound Name: | 3-[rel-(2R,6R)-2,8-dimethyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl]-N-[2-(1H-indol-3-yl)ethyl]benzamide |
| Molecular Weight: | 480.57 |
| Molecular Formula: | C29 H28 N4 O3 |
| Smiles: | Cc1ccc2c(c1)[C@H]1C[C@](C)(N(C(N1)=O)c1cccc(c1)C(NCCc1c[nH]c3ccccc13)=O)O2 |
| Stereo: | RELATIVE |
| logP: | 4.6772 |
| logD: | 4.6772 |
| logSw: | -4.4664 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 67.202 |
| InChI Key: | WCTQOJIHTWCJEU-UHFFFAOYSA-N |