4-{[2-(6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)hydrazinylidene]methyl}benzoic acid
Chemical Structure Depiction of
4-{[2-(6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)hydrazinylidene]methyl}benzoic acid
4-{[2-(6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)hydrazinylidene]methyl}benzoic acid
Compound characteristics
| Compound ID: | 2279-4285 |
| Compound Name: | 4-{[2-(6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)hydrazinylidene]methyl}benzoic acid |
| Molecular Weight: | 273.25 |
| Molecular Formula: | C12 H11 N5 O3 |
| Smiles: | CC1C(NC(N/N=C/c2ccc(cc2)C(O)=O)=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6052 |
| logD: | -2.0016 |
| logSw: | -2.0358 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.93 |
| InChI Key: | FPXQCTJEJKVIKI-UHFFFAOYSA-N |