7-(benzenesulfonyl)-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-(benzenesulfonyl)-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
7-(benzenesulfonyl)-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | S901-0633 |
| Compound Name: | 7-(benzenesulfonyl)-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 384.46 |
| Molecular Formula: | C19 H20 N4 O3 S |
| Smiles: | CCN1C(N2CCN(C(C2=N1)c1ccccc1)S(c1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1973 |
| logD: | 3.1973 |
| logSw: | -3.3217 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.744 |
| InChI Key: | MYARFEHQNQPVDO-QGZVFWFLSA-N |