3-[2-(1-benzofuran-2-yl)-2-oxoethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
3-[2-(1-benzofuran-2-yl)-2-oxoethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one
3-[2-(1-benzofuran-2-yl)-2-oxoethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one
Compound characteristics
| Compound ID: | D243-0376 |
| Compound Name: | 3-[2-(1-benzofuran-2-yl)-2-oxoethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-4(3H)-one |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C19 H15 N3 O3 S |
| Smiles: | C1CCc2c(C1)c1C(N(CC(c3cc4ccccc4o3)=O)N=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4072 |
| logD: | 4.4072 |
| logSw: | -4.6318 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.295 |
| InChI Key: | AAFZGRRQHYWWSB-UHFFFAOYSA-N |