9-nitro-3-(3,4,5-trimethoxybenzoyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
9-nitro-3-(3,4,5-trimethoxybenzoyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
9-nitro-3-(3,4,5-trimethoxybenzoyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | Y043-8034 |
| Compound Name: | 9-nitro-3-(3,4,5-trimethoxybenzoyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 429.43 |
| Molecular Formula: | C21 H23 N3 O7 |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1C[C@@H]2C[C@@H](C1)C1=CC=C(C(N1C2)=O)[N+]([O-])=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.0871 |
| logD: | 2.0871 |
| logSw: | -2.3779 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.394 |
| InChI Key: | UOQKXDPJXONOHA-OCCSQVGLSA-N |