N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | L386-0253 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 473.51 |
| Molecular Formula: | C24 H19 N5 O4 S |
| Smiles: | Cc1ccc(cc1)c1csc2C3=NN(CC(Nc4ccc5c(c4)OCCO5)=O)C(N3C=Nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2742 |
| logD: | 3.2742 |
| logSw: | -3.6059 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.155 |
| InChI Key: | BXWIVIYANDBUSM-UHFFFAOYSA-N |