ethyl 2-{[(1-benzofuran-2-carbonyl)carbamothioyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(1-benzofuran-2-carbonyl)carbamothioyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-{[(1-benzofuran-2-carbonyl)carbamothioyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
Compound ID: | 4059-2016 |
Compound Name: | ethyl 2-{[(1-benzofuran-2-carbonyl)carbamothioyl]amino}-4-methyl-1,3-thiazole-5-carboxylate |
Molecular Weight: | 389.45 |
Molecular Formula: | C17 H15 N3 O4 S2 |
Smiles: | CCOC(c1c(C)nc(NC(NC(c2cc3ccccc3o2)=O)=S)s1)=O |
Stereo: | ACHIRAL |
logP: | 4.5696 |
logD: | 4.5437 |
logSw: | -4.7165 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.91 |
InChI Key: | OMQQBHBFOLVSHL-UHFFFAOYSA-N |