3-(4-methoxybenzoyl)-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
3-(4-methoxybenzoyl)-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
3-(4-methoxybenzoyl)-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | Y043-8035 |
| Compound Name: | 3-(4-methoxybenzoyl)-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 369.38 |
| Molecular Formula: | C19 H19 N3 O5 |
| Smiles: | COc1ccc(cc1)C(N1C[C@@H]2C[C@H](C1)C1=CC=C(C(N1C2)=O)[N+]([O-])=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3544 |
| logD: | 2.3544 |
| logSw: | -2.451 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.96 |
| InChI Key: | RQDROHSPKXTCNU-JSGCOSHPSA-N |