ethyl 5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-2-(4-chlorobenzamido)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-2-(4-chlorobenzamido)-4-methylthiophene-3-carboxylate
ethyl 5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-2-(4-chlorobenzamido)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3058-5035 |
| Compound Name: | ethyl 5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-2-(4-chlorobenzamido)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 486.93 |
| Molecular Formula: | C23 H19 Cl N2 O6 S |
| Smiles: | CCOC(c1c(C)c(C(Nc2ccc3c(c2)OCO3)=O)sc1NC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6775 |
| logD: | -0.6631 |
| logSw: | -4.9953 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.084 |
| InChI Key: | AACGNFOXSAAELI-UHFFFAOYSA-N |