N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-1-methyl-1H-imidazole-4-sulfonamide
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]-1-methyl-1H-imidazole-4-sulfonamide
N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-1-methyl-1H-imidazole-4-sulfonamide
Compound characteristics
| Compound ID: | SC45-1072 |
| 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]-1-methyl-1H-imidazole-4-sulfonamide |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C18 H21 N7 O3 S |
| Smiles: | CC1C(N(Cc2ccccc2)Cc2c(CNS(c3cn(C)cn3)(=O)=O)nnn12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.2349 |
| logD: | -0.3103 |
| logSw: | -2.2714 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.113 |
| InChI Key: | XEWXUVPHTRIKFJ-ZDUSSCGKSA-N |