4-({2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)acetyl]hydrazinylidene}methyl)benzoic acid
Chemical Structure Depiction of
4-({2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)acetyl]hydrazinylidene}methyl)benzoic acid
4-({2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)acetyl]hydrazinylidene}methyl)benzoic acid
Compound characteristics
| Compound ID: | 2279-4341 |
| Compound Name: | 4-({2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)acetyl]hydrazinylidene}methyl)benzoic acid |
| Molecular Weight: | 317.26 |
| Molecular Formula: | C13 H11 N5 O5 |
| Smiles: | C(C1C(NC(NN=1)=O)=O)C(N/N=C/c1ccc(cc1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1007 |
| logD: | -3.7075 |
| logSw: | -1.8816 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 124.32 |
| InChI Key: | REHQOEYTCGUGMB-UHFFFAOYSA-N |