4-({2-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-ethoxyphenyl 3-methyl-4-nitrobenzoate
Chemical Structure Depiction of
4-({2-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-ethoxyphenyl 3-methyl-4-nitrobenzoate
4-({2-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-ethoxyphenyl 3-methyl-4-nitrobenzoate
Compound characteristics
| Compound ID: | 1015-0104 |
| Compound Name: | 4-({2-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-ethoxyphenyl 3-methyl-4-nitrobenzoate |
| Molecular Weight: | 588.67 |
| Molecular Formula: | C30 H36 N8 O5 |
| Smiles: | CCOc1cc(/C=N/Nc2nc(nc(n2)N2CCCCC2)N2CCCCC2)ccc1OC(c1ccc(c(C)c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4107 |
| logD: | 7.3176 |
| logSw: | -5.6201 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.89 |
| InChI Key: | UQGCLJNUQKPCJX-UHFFFAOYSA-N |