methyl 4-{[4-(methylamino)-6-(methylsulfanyl)-1,3,5-triazin-2-yl]oxy}benzoate
Chemical Structure Depiction of
methyl 4-{[4-(methylamino)-6-(methylsulfanyl)-1,3,5-triazin-2-yl]oxy}benzoate
methyl 4-{[4-(methylamino)-6-(methylsulfanyl)-1,3,5-triazin-2-yl]oxy}benzoate
Compound characteristics
| Compound ID: | 5664-0186 |
| Compound Name: | methyl 4-{[4-(methylamino)-6-(methylsulfanyl)-1,3,5-triazin-2-yl]oxy}benzoate |
| Molecular Weight: | 306.34 |
| Molecular Formula: | C13 H14 N4 O3 S |
| Smiles: | CNc1nc(nc(n1)SC)Oc1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.4207 |
| logD: | 3.4207 |
| logSw: | -3.8193 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.34 |
| InChI Key: | SIUPKCLIHKINBJ-UHFFFAOYSA-N |