3-ethyl-7-[(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine
Chemical Structure Depiction of
3-ethyl-7-[(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine
3-ethyl-7-[(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine
Compound characteristics
Compound ID: | T163-0384 |
Compound Name: | 3-ethyl-7-[(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine |
Molecular Weight: | 302.44 |
Molecular Formula: | C16 H22 N4 S |
Smiles: | CCc1nnc2CN(CCn12)Cc1csc2CCCCc12 |
Stereo: | ACHIRAL |
logP: | 2.3163 |
logD: | 0.9107 |
logSw: | -2.1051 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 30.5922 |
InChI Key: | ZHMQIILGZLDPRY-UHFFFAOYSA-N |