3,5-diethoxy-N-[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)carbamothioyl]benzamide
Chemical Structure Depiction of
3,5-diethoxy-N-[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)carbamothioyl]benzamide
3,5-diethoxy-N-[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)carbamothioyl]benzamide
Compound characteristics
Compound ID: | 4126-0639 |
Compound Name: | 3,5-diethoxy-N-[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)carbamothioyl]benzamide |
Molecular Weight: | 400.45 |
Molecular Formula: | C19 H20 N4 O4 S |
Smiles: | CCOc1cc(cc(c1)OCC)C(NC(Nc1ccc2c(c1)NC(N2)=O)=S)=O |
Stereo: | ACHIRAL |
logP: | 3.59 |
logD: | 3.5899 |
logSw: | -3.8003 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 83.214 |
InChI Key: | NYBNTKUYBCMDOZ-UHFFFAOYSA-N |