N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-3-methylthiophene-2-carboxamide
Chemical Structure Depiction of
N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-3-methylthiophene-2-carboxamide
N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-3-methylthiophene-2-carboxamide
Compound characteristics
| Compound ID: | SC45-1037 |
| Compound Name: | N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-3-methylthiophene-2-carboxamide |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C20 H21 N5 O2 S |
| Smiles: | CC1C(N(Cc2ccccc2)Cc2c(CNC(c3c(C)ccs3)=O)nnn12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.987 |
| logD: | 1.987 |
| logSw: | -2.3345 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.375 |
| InChI Key: | IATXTAHPEWYIGK-AWEZNQCLSA-N |