N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)methanesulfonamide
Chemical Structure Depiction of
N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)methanesulfonamide
N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)methanesulfonamide
Compound characteristics
| Compound ID: | D433-0796 |
| Compound Name: | N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-(4-methylphenyl)methanesulfonamide |
| Molecular Weight: | 347.39 |
| Molecular Formula: | C15 H17 N5 O3 S |
| Smiles: | CC1=CC(n2c(N1)nc(CN(c1ccc(C)cc1)S(C)(=O)=O)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1103 |
| logD: | -1.2769 |
| logSw: | -2.4107 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.313 |
| InChI Key: | MVVGNLXVUBNTCT-UHFFFAOYSA-N |