6-benzyl-3-{2-[(2-hydroxy-5-nitrophenyl)methylidene]hydrazinyl}-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
6-benzyl-3-{2-[(2-hydroxy-5-nitrophenyl)methylidene]hydrazinyl}-1,2,4-triazin-5(2H)-one
6-benzyl-3-{2-[(2-hydroxy-5-nitrophenyl)methylidene]hydrazinyl}-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | 4153-0058 |
| Compound Name: | 6-benzyl-3-{2-[(2-hydroxy-5-nitrophenyl)methylidene]hydrazinyl}-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 366.33 |
| Molecular Formula: | C17 H14 N6 O4 |
| Smiles: | C(C1C(N=C(N/N=C/c2cc(ccc2O)[N+]([O-])=O)NN=1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8431 |
| logD: | 2.2665 |
| logSw: | -3.2702 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 118.129 |
| InChI Key: | NPZKVQFWWSUGFO-UHFFFAOYSA-N |