3-(4-ethoxyanilino)-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
Chemical Structure Depiction of
3-(4-ethoxyanilino)-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
3-(4-ethoxyanilino)-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
Compound characteristics
Compound ID: | J087-0563 |
Compound Name: | 3-(4-ethoxyanilino)-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione |
Molecular Weight: | 414.48 |
Molecular Formula: | C21 H22 N2 O5 S |
Smiles: | CCOc1ccc(cc1)NC1=C(C(N2CCOCC2)=O)S(c2ccccc12)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.1572 |
logD: | 1.0638 |
logSw: | -2.9632 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.297 |
InChI Key: | MMTJCHWURRLVDW-UHFFFAOYSA-N |