N-(2-{3-[(2-anilino-2-oxoethyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}-4-methylphenyl)benzamide
Chemical Structure Depiction of
N-(2-{3-[(2-anilino-2-oxoethyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}-4-methylphenyl)benzamide
N-(2-{3-[(2-anilino-2-oxoethyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}-4-methylphenyl)benzamide
Compound characteristics
| Compound ID: | F151-0246 |
| Compound Name: | N-(2-{3-[(2-anilino-2-oxoethyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}-4-methylphenyl)benzamide |
| Molecular Weight: | 471.54 |
| Molecular Formula: | C25 H21 N5 O3 S |
| Smiles: | Cc1ccc(c(c1)C1C(NC(=NN=1)SCC(Nc1ccccc1)=O)=O)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7362 |
| logD: | 3.6553 |
| logSw: | -3.9156 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.339 |
| InChI Key: | OFWMBLASSMHNTH-UHFFFAOYSA-N |