2-(cyclopropylmethyl)-7-(2,5-dimethoxybenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
2-(cyclopropylmethyl)-7-(2,5-dimethoxybenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
2-(cyclopropylmethyl)-7-(2,5-dimethoxybenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | CM4439-1869 |
| Compound Name: | 2-(cyclopropylmethyl)-7-(2,5-dimethoxybenzene-1-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C17 H22 N4 O5 S |
| Smiles: | COc1ccc(c(c1)S(N1CCN2C(C1)=NN(CC1CC1)C2=O)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.7276 |
| logD: | 1.7276 |
| logSw: | -2.5714 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.334 |
| InChI Key: | HGNZBLQLWYAEQV-UHFFFAOYSA-N |