N-(2H-1,3-benzodioxol-5-yl)-2-[7-(4-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[7-(4-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[7-(4-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
Compound ID: | L114-0225 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[7-(4-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide |
Molecular Weight: | 419.46 |
Molecular Formula: | C22 H17 N3 O4 S |
Smiles: | Cc1ccc(cc1)c1csc2C(N(CC(Nc3ccc4c(c3)OCO4)=O)C=Nc12)=O |
Stereo: | ACHIRAL |
logP: | 4.0086 |
logD: | 4.0086 |
logSw: | -4.2927 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.099 |
InChI Key: | OACYVWSXEJLIPA-UHFFFAOYSA-N |