dimethyl 2-(2-bromobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-(2-bromobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
dimethyl 2-(2-bromobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Compound characteristics
| Compound ID: | 2798-0037 |
| Compound Name: | dimethyl 2-(2-bromobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate |
| Molecular Weight: | 438.29 |
| Molecular Formula: | C18 H16 Br N O5 S |
| Smiles: | COC(C1CCc2c1c(C(=O)OC)c(NC(c1ccccc1[Br])=O)s2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2768 |
| logD: | -0.8032 |
| logSw: | -3.8315 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.758 |
| InChI Key: | CJYHZMKQISGERE-JTQLQIEISA-N |