4-(azepan-1-yl)-N-(4-bromophenyl)-6-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-(azepan-1-yl)-N-(4-bromophenyl)-6-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-1,3,5-triazin-2-amine
4-(azepan-1-yl)-N-(4-bromophenyl)-6-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | 3476-0469 |
| Compound Name: | 4-(azepan-1-yl)-N-(4-bromophenyl)-6-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-1,3,5-triazin-2-amine |
| Molecular Weight: | 486.44 |
| Molecular Formula: | C21 H24 Br N7 S |
| Smiles: | Cc1cc(C)nc(n1)Sc1nc(Nc2ccc(cc2)[Br])nc(n1)N1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 7.0341 |
| logD: | 7.0257 |
| logSw: | -5.7708 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.218 |
| InChI Key: | XYBCJYRPSZBFMZ-UHFFFAOYSA-N |