3-{[3-(4-fluorobenzoyl)-5-hydroxy-1-benzofuran-4-yl]methyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
3-{[3-(4-fluorobenzoyl)-5-hydroxy-1-benzofuran-4-yl]methyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
3-{[3-(4-fluorobenzoyl)-5-hydroxy-1-benzofuran-4-yl]methyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | Y043-6009 |
| Compound Name: | 3-{[3-(4-fluorobenzoyl)-5-hydroxy-1-benzofuran-4-yl]methyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C27 H23 F N2 O4 |
| Smiles: | C1[C@H]2CN(Cc3c(ccc4c3c(co4)C(c3ccc(cc3)F)=O)O)C[C@@H]1CN1C2=CC=CC1=O |
| Stereo: | ABSOLUTE |
| logP: | 4.2087 |
| logD: | 4.188 |
| logSw: | -4.3962 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.245 |
| InChI Key: | WNFHFICIGHUZFJ-WMZOPIPTSA-N |