4-({2-[6-(hydroxymethyl)pyridine-3-carbonyl]hydrazinylidene}methyl)-2-methoxyphenyl 4-nitrobenzoate
Chemical Structure Depiction of
4-({2-[6-(hydroxymethyl)pyridine-3-carbonyl]hydrazinylidene}methyl)-2-methoxyphenyl 4-nitrobenzoate
4-({2-[6-(hydroxymethyl)pyridine-3-carbonyl]hydrazinylidene}methyl)-2-methoxyphenyl 4-nitrobenzoate
Compound characteristics
Compound ID: | 8005-6523 |
Compound Name: | 4-({2-[6-(hydroxymethyl)pyridine-3-carbonyl]hydrazinylidene}methyl)-2-methoxyphenyl 4-nitrobenzoate |
Molecular Weight: | 450.41 |
Molecular Formula: | C22 H18 N4 O7 |
Smiles: | COc1cc(/C=N/NC(c2ccc(CO)nc2)=O)ccc1OC(c1ccc(cc1)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 2.5986 |
logD: | 2.587 |
logSw: | -2.9705 |
Hydrogen bond acceptors count: | 13 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 123.779 |
InChI Key: | NQTVDLVADYFFGB-UHFFFAOYSA-N |