2-(5-bromo-2-hydroxy-3-methoxyphenyl)-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Chemical Structure Depiction of
2-(5-bromo-2-hydroxy-3-methoxyphenyl)-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
2-(5-bromo-2-hydroxy-3-methoxyphenyl)-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Compound characteristics
| Compound ID: | 5510-0938 |
| Compound Name: | 2-(5-bromo-2-hydroxy-3-methoxyphenyl)-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol |
| Molecular Weight: | 424.31 |
| Molecular Formula: | C17 H18 Br N3 O3 S |
| Smiles: | CN1CCc2c3C(=NC(c4cc(cc(c4O)OC)[Br])Nc3sc2C1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7102 |
| logD: | 2.3333 |
| logSw: | -3.0091 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.129 |
| InChI Key: | BNJJEGJYFCYZKL-OAHLLOKOSA-N |