7-(hex-5-ynoyl)-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
7-(hex-5-ynoyl)-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
7-(hex-5-ynoyl)-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | T003-0536 |
| Compound Name: | 7-(hex-5-ynoyl)-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 276.34 |
| Molecular Formula: | C14 H20 N4 O2 |
| Smiles: | CCCN1C(N2CCN(CC2=N1)C(CCCC#C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2027 |
| logD: | 1.2024 |
| logSw: | -1.2067 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.569 |
| InChI Key: | RJGCDZZWFWOEJK-UHFFFAOYSA-N |