N-(4-bromophenyl)-2-(3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-(3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
N-(4-bromophenyl)-2-(3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | L386-0043 |
| Compound Name: | N-(4-bromophenyl)-2-(3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide |
| Molecular Weight: | 404.24 |
| Molecular Formula: | C15 H10 Br N5 O2 S |
| Smiles: | C(C(Nc1ccc(cc1)[Br])=O)N1C(N2C=Nc3ccsc3C2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9369 |
| logD: | 2.9369 |
| logSw: | -3.5004 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.855 |
| InChI Key: | VPVOXPUOXXMIAR-UHFFFAOYSA-N |