N-{2-[3-(benzylsulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}propanamide
Chemical Structure Depiction of
N-{2-[3-(benzylsulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}propanamide
N-{2-[3-(benzylsulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}propanamide
Compound characteristics
| Compound ID: | F151-0375 |
| Compound Name: | N-{2-[3-(benzylsulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]phenyl}propanamide |
| Molecular Weight: | 366.44 |
| Molecular Formula: | C19 H18 N4 O2 S |
| Smiles: | CCC(Nc1ccccc1C1C(NC(=NN=1)SCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7864 |
| logD: | 2.6871 |
| logSw: | -3.6404 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.247 |
| InChI Key: | BVDUUBVULFMAJH-UHFFFAOYSA-N |