ethyl 5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-4-methyl-2-[(thiophene-2-carbonyl)amino]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-4-methyl-2-[(thiophene-2-carbonyl)amino]thiophene-3-carboxylate
ethyl 5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-4-methyl-2-[(thiophene-2-carbonyl)amino]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3058-5030 |
| Compound Name: | ethyl 5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-4-methyl-2-[(thiophene-2-carbonyl)amino]thiophene-3-carboxylate |
| Molecular Weight: | 458.51 |
| Molecular Formula: | C21 H18 N2 O6 S2 |
| Smiles: | CCOC(c1c(C)c(C(Nc2ccc3c(c2)OCO3)=O)sc1NC(c1cccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9953 |
| logD: | 0.4921 |
| logSw: | -4.1565 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.103 |
| InChI Key: | BMFZOMRYTMZVFG-UHFFFAOYSA-N |