3-[(4-nitro-1H-indol-1-yl)acetyl]-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-nitro-1H-indol-1-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
3-[(4-nitro-1H-indol-1-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | Y043-4669 |
| Compound Name: | 3-[(4-nitro-1H-indol-1-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 392.41 |
| Molecular Formula: | C21 H20 N4 O4 |
| Smiles: | C1[C@H]2CN(C[C@@H]1CN1C2=CC=CC1=O)C(Cn1ccc2c(cccc12)[N+]([O-])=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.4615 |
| logD: | 2.4615 |
| logSw: | -2.5142 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.249 |
| InChI Key: | YBAPPMMBRXEZTL-GJZGRUSLSA-N |