2-(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-ethoxyphenyl)-2H-benzotriazole
Chemical Structure Depiction of
2-(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-ethoxyphenyl)-2H-benzotriazole
2-(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-ethoxyphenyl)-2H-benzotriazole
Compound characteristics
| Compound ID: | 8016-6412 |
| Compound Name: | 2-(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-ethoxyphenyl)-2H-benzotriazole |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C21 H21 N5 O S |
| Smiles: | CCOc1ccc(CSc2nc(C)cc(C)n2)cc1n1nc2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7478 |
| logD: | 4.7478 |
| logSw: | -4.5656 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.817 |
| InChI Key: | GJUQHCUSTMJPAI-UHFFFAOYSA-N |