ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-0439 |
| Compound Name: | ethyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 432.49 |
| Molecular Formula: | C21 H24 N2 O6 S |
| Smiles: | CCN(CC)C(c1c(C)c(C(=O)OCC)c(NC(c2ccc3c(c2)OCO3)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2068 |
| logD: | 1.0727 |
| logSw: | -3.4887 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.925 |
| InChI Key: | RSKAQYIYRSUTDH-UHFFFAOYSA-N |