N-(4-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]methanesulfonamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]methanesulfonamide
N-(4-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]methanesulfonamide
Compound characteristics
| Compound ID: | D433-0946 |
| Compound Name: | N-(4-methoxyphenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]methanesulfonamide |
| Molecular Weight: | 363.39 |
| Molecular Formula: | C15 H17 N5 O4 S |
| Smiles: | CC1=CC(n2c(N1)nc(CN(c1ccc(cc1)OC)S(C)(=O)=O)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6693 |
| logD: | -1.7179 |
| logSw: | -2.36 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.857 |
| InChI Key: | PKRKFFBIUHVNOE-UHFFFAOYSA-N |