5-(3-fluorobenzoyl)-2-methyl-3-phenyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Chemical Structure Depiction of
5-(3-fluorobenzoyl)-2-methyl-3-phenyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
5-(3-fluorobenzoyl)-2-methyl-3-phenyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Compound characteristics
| Compound ID: | C298-0089 |
| Compound Name: | 5-(3-fluorobenzoyl)-2-methyl-3-phenyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one |
| Molecular Weight: | 402.42 |
| Molecular Formula: | C24 H19 F N2 O3 |
| Smiles: | CC12CC(c3ccccc3O2)N(C(c2cccc(c2)F)=O)C(N1c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2275 |
| logD: | 4.2275 |
| logSw: | -4.5301 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.191 |
| InChI Key: | RQVBZJYVFXXBFL-UHFFFAOYSA-N |