7-(2,5-dimethoxybenzene-1-sulfonyl)-2-methyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
7-(2,5-dimethoxybenzene-1-sulfonyl)-2-methyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
7-(2,5-dimethoxybenzene-1-sulfonyl)-2-methyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | S901-0381 |
| Compound Name: | 7-(2,5-dimethoxybenzene-1-sulfonyl)-2-methyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 430.48 |
| Molecular Formula: | C20 H22 N4 O5 S |
| Smiles: | CN1C(N2CCN(C(C2=N1)c1ccccc1)S(c1cc(ccc1OC)OC)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8277 |
| logD: | 2.8277 |
| logSw: | -3.3744 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.872 |
| InChI Key: | NOGUNDAPCZLWAU-GOSISDBHSA-N |