2-(2-ethylanilino)-N-[(3-methoxyphenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(2-ethylanilino)-N-[(3-methoxyphenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-(2-ethylanilino)-N-[(3-methoxyphenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
Compound ID: | E796-0139 |
Compound Name: | 2-(2-ethylanilino)-N-[(3-methoxyphenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
Molecular Weight: | 485.56 |
Molecular Formula: | C26 H23 N5 O3 S |
Smiles: | CCc1ccccc1NC1=NN2C(=Nc3cc(ccc3C2=O)C(NCc2cccc(c2)OC)=O)S1 |
Stereo: | ACHIRAL |
logP: | 4.5778 |
logD: | 4.5729 |
logSw: | -4.3957 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.126 |
InChI Key: | HOGDZQLPRUMCSX-UHFFFAOYSA-N |