2-({[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-4-hydroxy-6-(4-methylphenyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-({[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-4-hydroxy-6-(4-methylphenyl)pyrimidine-5-carbonitrile
2-({[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-4-hydroxy-6-(4-methylphenyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | Y020-6989 |
| Compound Name: | 2-({[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-4-hydroxy-6-(4-methylphenyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 472.53 |
| Molecular Formula: | C23 H20 N8 O2 S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(nc(n1)SCc1nc(N)nc(Nc2ccc(cc2)OC)n1)O |
| Stereo: | ACHIRAL |
| logP: | 4.3241 |
| logD: | 0.5861 |
| logSw: | -4.517 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 120.689 |
| InChI Key: | UVMKGISMSRLFIJ-UHFFFAOYSA-N |