ethyl (2-{[N-(1-benzofuran-2-carbonyl)-D-alanyl]amino}-1,3-thiazol-4-yl)acetate
Chemical Structure Depiction of
ethyl (2-{[N-(1-benzofuran-2-carbonyl)-D-alanyl]amino}-1,3-thiazol-4-yl)acetate
ethyl (2-{[N-(1-benzofuran-2-carbonyl)-D-alanyl]amino}-1,3-thiazol-4-yl)acetate
Compound characteristics
Compound ID: | Y041-5108 |
Compound Name: | ethyl (2-{[N-(1-benzofuran-2-carbonyl)-D-alanyl]amino}-1,3-thiazol-4-yl)acetate |
Molecular Weight: | 401.44 |
Molecular Formula: | C19 H19 N3 O5 S |
Smiles: | CCOC(Cc1csc(NC([C@@H](C)NC(c2cc3ccccc3o2)=O)=O)n1)=O |
Stereo: | ABSOLUTE |
logP: | 3.4469 |
logD: | 3.4449 |
logSw: | -3.735 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.171 |
InChI Key: | LKPWQLJLGPAFQU-LLVKDONJSA-N |