N-(4-methoxyphenyl)-3,5-dimethyl-N-[2-oxo-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)ethyl]-1,2-oxazole-4-sulfonamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-3,5-dimethyl-N-[2-oxo-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)ethyl]-1,2-oxazole-4-sulfonamide
N-(4-methoxyphenyl)-3,5-dimethyl-N-[2-oxo-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)ethyl]-1,2-oxazole-4-sulfonamide
Compound characteristics
| Compound ID: | C517-4042 |
| Compound Name: | N-(4-methoxyphenyl)-3,5-dimethyl-N-[2-oxo-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)ethyl]-1,2-oxazole-4-sulfonamide |
| Molecular Weight: | 512.58 |
| Molecular Formula: | C25 H28 N4 O6 S |
| Smiles: | Cc1c(c(C)on1)S(N(CC(N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O)c1ccc(cc1)OC)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0279 |
| logD: | 2.0279 |
| logSw: | -2.5491 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 93.466 |
| InChI Key: | PPNMLRYOOYJIME-UHFFFAOYSA-N |