2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one--hydrogen chloride (1/1)
2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | S901-0003 |
| Compound Name: | 2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 280.75 |
| Molecular Formula: | C13 H16 N4 O |
| Salt: | HCl |
| Smiles: | CCN1C(N2CCNC(C2=N1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.072 |
| logD: | 0.1088 |
| logSw: | -1.7801 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.201 |
| InChI Key: | RDRGMLTUONPQBS-LLVKDONJSA-N |