7-(3,4-dimethoxybenzene-1-sulfonyl)-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
7-(3,4-dimethoxybenzene-1-sulfonyl)-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
7-(3,4-dimethoxybenzene-1-sulfonyl)-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | S901-0697 |
| Compound Name: | 7-(3,4-dimethoxybenzene-1-sulfonyl)-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C21 H24 N4 O5 S |
| Smiles: | CCN1C(N2CCN(C(C2=N1)c1ccccc1)S(c1ccc(c(c1)OC)OC)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9886 |
| logD: | 2.9886 |
| logSw: | -3.348 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.005 |
| InChI Key: | LOZJPDOHZBUCKD-LJQANCHMSA-N |