ethyl 5-acetyl-4-methyl-2-[2-(3-methyl-4-nitrophenoxy)acetamido]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-4-methyl-2-[2-(3-methyl-4-nitrophenoxy)acetamido]thiophene-3-carboxylate
ethyl 5-acetyl-4-methyl-2-[2-(3-methyl-4-nitrophenoxy)acetamido]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3772-2009 |
| Compound Name: | ethyl 5-acetyl-4-methyl-2-[2-(3-methyl-4-nitrophenoxy)acetamido]thiophene-3-carboxylate |
| Molecular Weight: | 420.44 |
| Molecular Formula: | C19 H20 N2 O7 S |
| Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(COc1ccc(c(C)c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4808 |
| logD: | 0.7496 |
| logSw: | -4.1744 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.071 |
| InChI Key: | DTVTZASAWVPWEH-UHFFFAOYSA-N |