4-{[(5-{[(naphthalen-1-yl)oxy]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-{[(5-{[(naphthalen-1-yl)oxy]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
4-{[(5-{[(naphthalen-1-yl)oxy]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | 8016-3051 |
| Compound Name: | 4-{[(5-{[(naphthalen-1-yl)oxy]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-6-(piperidin-1-yl)-1,3,5-triazin-2-amine |
| Molecular Weight: | 524.65 |
| Molecular Formula: | C28 H28 N8 O S |
| Smiles: | C1CCN(CC1)c1nc(CSc2nnc(COc3cccc4ccccc34)n2c2ccccc2)nc(N)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7852 |
| logD: | 5.7852 |
| logSw: | -7.0596 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.705 |
| InChI Key: | AIVNKLRSHZWJMT-UHFFFAOYSA-N |