4-({2-[4-anilino-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-methoxyphenyl 3-bromobenzoate
Chemical Structure Depiction of
4-({2-[4-anilino-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-methoxyphenyl 3-bromobenzoate
4-({2-[4-anilino-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-methoxyphenyl 3-bromobenzoate
Compound characteristics
| Compound ID: | 3229-0839 |
| Compound Name: | 4-({2-[4-anilino-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-2-methoxyphenyl 3-bromobenzoate |
| Molecular Weight: | 602.49 |
| Molecular Formula: | C29 H28 Br N7 O3 |
| Smiles: | COc1cc(/C=N/Nc2nc(Nc3ccccc3)nc(n2)N2CCCCC2)ccc1OC(c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 7.797 |
| logD: | 7.7959 |
| logSw: | -5.7704 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.897 |
| InChI Key: | KHBOYMJILQVVIV-UHFFFAOYSA-N |