N~1~-benzyl-N~2~-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanediamide
Chemical Structure Depiction of
N~1~-benzyl-N~2~-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanediamide
N~1~-benzyl-N~2~-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanediamide
Compound characteristics
Compound ID: | 8640-0049 |
Compound Name: | N~1~-benzyl-N~2~-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanediamide |
Molecular Weight: | 343.4 |
Molecular Formula: | C17 H17 N3 O3 S |
Smiles: | [H]N([H])C(c1c2CCCc2sc1N([H])C(C(N([H])Cc1ccccc1)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 0.7479 |
logD: | -3.6422 |
logSw: | -1.925 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 82.154 |
InChI Key: | JTUMCAJMIIMBBK-UHFFFAOYSA-N |