dimethyl 2-[(2,3-dihydro-1,4-benzodioxine-2-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[(2,3-dihydro-1,4-benzodioxine-2-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
dimethyl 2-[(2,3-dihydro-1,4-benzodioxine-2-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Compound characteristics
| Compound ID: | 2798-0890 |
| Compound Name: | dimethyl 2-[(2,3-dihydro-1,4-benzodioxine-2-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate |
| Molecular Weight: | 417.44 |
| Molecular Formula: | C20 H19 N O7 S |
| Smiles: | COC(C1CCc2c1c(C(=O)OC)c(NC(C1COc3ccccc3O1)=O)s2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.94 |
| logD: | 0.4645 |
| logSw: | -3.4847 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.195 |
| InChI Key: | BZQPMHRJWHCVHM-UHFFFAOYSA-N |