4-({2-[4-anilino-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-ethoxyphenyl 2-iodobenzoate
Chemical Structure Depiction of
4-({2-[4-anilino-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-ethoxyphenyl 2-iodobenzoate
4-({2-[4-anilino-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-ethoxyphenyl 2-iodobenzoate
Compound characteristics
| Compound ID: | 3229-2828 |
| Compound Name: | 4-({2-[4-anilino-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-ethoxyphenyl 2-iodobenzoate |
| Molecular Weight: | 649.49 |
| Molecular Formula: | C29 H28 I N7 O3 |
| Smiles: | CCOc1cc(/C=N/Nc2nc(Nc3ccccc3)nc(n2)N2CCCC2)ccc1OC(c1ccccc1I)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5176 |
| logD: | 7.5166 |
| logSw: | -5.7369 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.843 |
| InChI Key: | NEMITTYEAZKPOH-UHFFFAOYSA-N |