N-(3,4-dimethoxyphenyl)-4-ethyl-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-4-ethyl-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide
N-(3,4-dimethoxyphenyl)-4-ethyl-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide
Compound characteristics
Compound ID: | P666-2084 |
Compound Name: | N-(3,4-dimethoxyphenyl)-4-ethyl-1-oxo-1,2-dihydropyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide |
Molecular Weight: | 378.4 |
Molecular Formula: | C16 H18 N4 O5 S |
Smiles: | CCC1=NNC(c2cc(cn12)S(Nc1ccc(c(c1)OC)OC)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.2469 |
logD: | 1.2199 |
logSw: | -2.5203 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 96.357 |
InChI Key: | QTMMKZXTPPKVBH-UHFFFAOYSA-N |