2-(5-hydroxy-2-nitrophenyl)-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-hydroxy-2-nitrophenyl)-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
2-(5-hydroxy-2-nitrophenyl)-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Compound characteristics
| Compound ID: | 5381-0092 |
| Compound Name: | 2-(5-hydroxy-2-nitrophenyl)-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol |
| Molecular Weight: | 360.39 |
| Molecular Formula: | C16 H16 N4 O4 S |
| Smiles: | CN1CCc2c3C(=NC(c4cc(ccc4[N+]([O-])=O)O)Nc3sc2C1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6516 |
| logD: | 1.6516 |
| logSw: | -2.2937 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.717 |
| InChI Key: | RYQQMBMIOLYZOT-CQSZACIVSA-N |