N-(4-bromophenyl)-2-(8,9-dimethyl-3-oxothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-(8,9-dimethyl-3-oxothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
N-(4-bromophenyl)-2-(8,9-dimethyl-3-oxothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F815-0160 |
| Compound Name: | N-(4-bromophenyl)-2-(8,9-dimethyl-3-oxothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide |
| Molecular Weight: | 432.3 |
| Molecular Formula: | C17 H14 Br N5 O2 S |
| Smiles: | Cc1c2C3=NN(CC(Nc4ccc(cc4)[Br])=O)C(N3C=Nc2sc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.595 |
| logD: | 3.5949 |
| logSw: | -3.9543 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.739 |
| InChI Key: | BFKGUAGZFSWJHL-UHFFFAOYSA-N |