2-(2-bromophenoxy)-N-[2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
2-(2-bromophenoxy)-N-[2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
2-(2-bromophenoxy)-N-[2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | K292-1698 |
| Compound Name: | 2-(2-bromophenoxy)-N-[2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 547.4 |
| Molecular Formula: | C21 H15 Br N4 O5 S2 |
| Smiles: | C(C(NN1C(=Nc2ccsc2C1=O)SCc1ccc(cc1)[N+]([O-])=O)=O)Oc1ccccc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.019 |
| logD: | 4.019 |
| logSw: | -4.3554 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.945 |
| InChI Key: | BHZZJSRHAMPTHB-UHFFFAOYSA-N |