3-({[(4-ethylphenoxy)acetyl]carbamothioyl}amino)-4-methoxybenzoic acid
Chemical Structure Depiction of
3-({[(4-ethylphenoxy)acetyl]carbamothioyl}amino)-4-methoxybenzoic acid
3-({[(4-ethylphenoxy)acetyl]carbamothioyl}amino)-4-methoxybenzoic acid
Compound characteristics
| Compound ID: | 5464-0078 |
| Compound Name: | 3-({[(4-ethylphenoxy)acetyl]carbamothioyl}amino)-4-methoxybenzoic acid |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C19 H20 N2 O5 S |
| Smiles: | CCc1ccc(cc1)OCC(NC(Nc1cc(ccc1OC)C(O)=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9893 |
| logD: | 1.9735 |
| logSw: | -4.048 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.866 |
| InChI Key: | ZRUJXUCWVMCLOC-UHFFFAOYSA-N |