3-(3,4-dimethoxybenzoyl)-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-dimethoxybenzoyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
3-(3,4-dimethoxybenzoyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | Y041-6548 |
| Compound Name: | 3-(3,4-dimethoxybenzoyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 354.4 |
| Molecular Formula: | C20 H22 N2 O4 |
| Smiles: | COc1ccc(cc1OC)C(N1C[C@H]2C[C@H](C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8856 |
| logD: | 1.8856 |
| logSw: | -2.2791 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.846 |
| InChI Key: | WWWDAHVNLIIAGH-UHFFFAOYSA-N |