3-[3-(4-methoxy-1H-indol-1-yl)propanoyl]-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-[3-(4-methoxy-1H-indol-1-yl)propanoyl]-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
3-[3-(4-methoxy-1H-indol-1-yl)propanoyl]-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: | Y043-8016 |
| Compound Name: | 3-[3-(4-methoxy-1H-indol-1-yl)propanoyl]-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 436.47 |
| Molecular Formula: | C23 H24 N4 O5 |
| Smiles: | COc1cccc2c1ccn2CCC(N1CC2C[C@@H](C1)CN1C2=CC=C(C1=O)[N+]([O-])=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.9479 |
| logD: | 2.9479 |
| logSw: | -3.1294 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.608 |
| InChI Key: | NVFFPSSFPDZDFK-AAFJCEBUSA-N |