diethyl 5-{[(4-methoxybenzoyl)carbamothioyl]amino}-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-{[(4-methoxybenzoyl)carbamothioyl]amino}-3-methylthiophene-2,4-dicarboxylate
diethyl 5-{[(4-methoxybenzoyl)carbamothioyl]amino}-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 1895-0056 |
| Compound Name: | diethyl 5-{[(4-methoxybenzoyl)carbamothioyl]amino}-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 450.53 |
| Molecular Formula: | C20 H22 N2 O6 S2 |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(NC(c1ccc(cc1)OC)=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.037 |
| logD: | 2.3986 |
| logSw: | -4.3037 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.085 |
| InChI Key: | ARDAVCFOWDVPNZ-UHFFFAOYSA-N |