2-(cyclopropylmethyl)-7-(1-ethyl-1H-pyrazole-4-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
2-(cyclopropylmethyl)-7-(1-ethyl-1H-pyrazole-4-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
2-(cyclopropylmethyl)-7-(1-ethyl-1H-pyrazole-4-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
Compound ID: | CM4439-2367 |
Compound Name: | 2-(cyclopropylmethyl)-7-(1-ethyl-1H-pyrazole-4-sulfonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
Molecular Weight: | 352.41 |
Molecular Formula: | C14 H20 N6 O3 S |
Smiles: | CCn1cc(cn1)S(N1CCN2C(C1)=NN(CC1CC1)C2=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 0.3626 |
logD: | 0.3626 |
logSw: | -1.3757 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 79.662 |
InChI Key: | RJLVKMRKCVYAKY-UHFFFAOYSA-N |