N-(2-{5-oxo-3-[(2-phenoxyethyl)sulfanyl]-4,5-dihydro-1,2,4-triazin-6-yl}phenyl)propanamide
Chemical Structure Depiction of
N-(2-{5-oxo-3-[(2-phenoxyethyl)sulfanyl]-4,5-dihydro-1,2,4-triazin-6-yl}phenyl)propanamide
N-(2-{5-oxo-3-[(2-phenoxyethyl)sulfanyl]-4,5-dihydro-1,2,4-triazin-6-yl}phenyl)propanamide
Compound characteristics
| Compound ID: | F151-0377 |
| Compound Name: | N-(2-{5-oxo-3-[(2-phenoxyethyl)sulfanyl]-4,5-dihydro-1,2,4-triazin-6-yl}phenyl)propanamide |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C20 H20 N4 O3 S |
| Smiles: | CCC(Nc1ccccc1C1C(NC(=NN=1)SCCOc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1326 |
| logD: | 2.9727 |
| logSw: | -3.5993 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.665 |
| InChI Key: | RMQYDXKJRDKDPV-UHFFFAOYSA-N |