ethyl 2-[2-(benzylamino)(oxo)acetamido]-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(benzylamino)(oxo)acetamido]-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
ethyl 2-[2-(benzylamino)(oxo)acetamido]-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Compound characteristics
Compound ID: | 8640-0042 |
Compound Name: | ethyl 2-[2-(benzylamino)(oxo)acetamido]-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate |
Molecular Weight: | 416.49 |
Molecular Formula: | C21 H24 N2 O5 S |
Smiles: | [H]N(Cc1ccccc1)C(C(N([H])c1c(C(=O)OCC)c2CC(C)(C)OCc2s1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1469 |
logD: | -3.314 |
logSw: | -3.3328 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 76.18 |
InChI Key: | BNXAJGYQRIABBS-UHFFFAOYSA-N |