3-[7-(3,5-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-[7-(3,5-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
3-[7-(3,5-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | G298-0378 |
| Compound Name: | 3-[7-(3,5-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide |
| Molecular Weight: | 494.57 |
| Molecular Formula: | C24 H26 N6 O4 S |
| Smiles: | Cc1cc(C)cc(c1)N1C=Cn2c(CCC(NCCc3ccc(cc3)S(N)(=O)=O)=O)nnc2C1=O |
| Stereo: | ACHIRAL |
| logP: | -0.0496 |
| logD: | -0.0503 |
| logSw: | -2.1819 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.013 |
| InChI Key: | ODMPDMINOACGFX-UHFFFAOYSA-N |