N-[2-(5-oxo-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)phenyl]acetamide
Chemical Structure Depiction of
N-[2-(5-oxo-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)phenyl]acetamide
N-[2-(5-oxo-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | 3509-0141 |
| Compound Name: | N-[2-(5-oxo-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)phenyl]acetamide |
| Molecular Weight: | 262.29 |
| Molecular Formula: | C11 H10 N4 O2 S |
| Smiles: | CC(Nc1ccccc1C1C(NC(NN=1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8709 |
| logD: | 0.7245 |
| logSw: | -2.2933 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.182 |
| InChI Key: | QFZMBKAZUWMHND-UHFFFAOYSA-N |