2-(4-bromophenyl)-6,6-dimethyl-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-(4-bromophenyl)-6,6-dimethyl-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
2-(4-bromophenyl)-6,6-dimethyl-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 8640-0255 |
| Compound Name: | 2-(4-bromophenyl)-6,6-dimethyl-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 393.3 |
| Molecular Formula: | C17 H17 Br N2 O2 S |
| Smiles: | [H]N1C(c2ccc(cc2)[Br])N([H])c2c(C1=O)c1CC(C)(C)OCc1s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9153 |
| logD: | 3.9152 |
| logSw: | -4.3933 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.897 |
| InChI Key: | TWALZCCEBJQDCU-CQSZACIVSA-N |