(6S)-N-[(1H-benzimidazol-2-yl)methyl]-4-oxo-6-(propan-2-yl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide
Chemical Structure Depiction of
(6S)-N-[(1H-benzimidazol-2-yl)methyl]-4-oxo-6-(propan-2-yl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide
(6S)-N-[(1H-benzimidazol-2-yl)methyl]-4-oxo-6-(propan-2-yl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide
Compound characteristics
Compound ID: | SD69-0622 |
Compound Name: | (6S)-N-[(1H-benzimidazol-2-yl)methyl]-4-oxo-6-(propan-2-yl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide |
Molecular Weight: | 353.38 |
Molecular Formula: | C17 H19 N7 O2 |
Smiles: | CC(C)[C@H]1Cn2c(C(N1)=O)c(C(NCc1nc3ccccc3[nH]1)=O)nn2 |
Stereo: | ABSOLUTE |
logP: | 0.9477 |
logD: | 0.9465 |
logSw: | -1.8176 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 96.541 |
InChI Key: | XLTCZIVFDINDRB-GFCCVEGCSA-N |