4-(2-{[2,4-bis(4-methylpiperidin-1-yl)-5-nitrophenyl]methylidene}hydrazinyl)-N-(4-fluorophenyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine--acetic acid (1/1)
Chemical Structure Depiction of
4-(2-{[2,4-bis(4-methylpiperidin-1-yl)-5-nitrophenyl]methylidene}hydrazinyl)-N-(4-fluorophenyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine--acetic acid (1/1)
4-(2-{[2,4-bis(4-methylpiperidin-1-yl)-5-nitrophenyl]methylidene}hydrazinyl)-N-(4-fluorophenyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine--acetic acid (1/1)
Compound characteristics
| Compound ID: | 2144-0934 |
| Compound Name: | 4-(2-{[2,4-bis(4-methylpiperidin-1-yl)-5-nitrophenyl]methylidene}hydrazinyl)-N-(4-fluorophenyl)-6-(piperidin-1-yl)-1,3,5-triazin-2-amine--acetic acid (1/1) |
| Molecular Weight: | 690.82 |
| Molecular Formula: | C33 H43 F N10 O2 |
| Salt: | CH3COOH |
| Smiles: | [H]N(c1ccc(cc1)F)c1nc(nc(n1)N([H])/N=C/c1cc(c(cc1N1CCC(C)CC1)N1CCC(C)CC1)[N+]([O-])=O)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 9.0734 |
| logD: | 9.0732 |
| logSw: | -5.7945 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.186 |
| InChI Key: | JQAPCVZJKAGQCO-FADJLKOXSA-N |