N-(2-{2-[(2-hydroxy-3,5-dinitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-(2-{2-[(2-hydroxy-3,5-dinitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-3,4-dimethoxybenzamide
N-(2-{2-[(2-hydroxy-3,5-dinitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | 8005-6536 |
| Compound Name: | N-(2-{2-[(2-hydroxy-3,5-dinitrophenyl)methylidene]hydrazinyl}-2-oxoethyl)-3,4-dimethoxybenzamide |
| Molecular Weight: | 447.36 |
| Molecular Formula: | C18 H17 N5 O9 |
| Smiles: | COc1ccc(cc1OC)C(NCC(N/N=C/c1cc(cc(c1O)[N+]([O-])=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2071 |
| logD: | -1.218 |
| logSw: | -2.8462 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 157.228 |
| InChI Key: | HUVCVWYBCNYTKA-UHFFFAOYSA-N |