5-(3,5-dimethoxybenzoyl)-3-(4-fluorophenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Chemical Structure Depiction of
5-(3,5-dimethoxybenzoyl)-3-(4-fluorophenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
5-(3,5-dimethoxybenzoyl)-3-(4-fluorophenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Compound characteristics
| Compound ID: | C298-0087 |
| Compound Name: | 5-(3,5-dimethoxybenzoyl)-3-(4-fluorophenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one |
| Molecular Weight: | 462.48 |
| Molecular Formula: | C26 H23 F N2 O5 |
| Smiles: | CC12CC(c3ccccc3O2)N(C(c2cc(cc(c2)OC)OC)=O)C(N1c1ccc(cc1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5392 |
| logD: | 4.5392 |
| logSw: | -4.5215 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.279 |
| InChI Key: | SUXSAVMMVNVHIW-UHFFFAOYSA-N |