2-(4-bromobenzamido)-N-(2-ethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
2-(4-bromobenzamido)-N-(2-ethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
2-(4-bromobenzamido)-N-(2-ethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3261-0882 |
| Compound Name: | 2-(4-bromobenzamido)-N-(2-ethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 513.45 |
| Molecular Formula: | C25 H25 Br N2 O3 S |
| Smiles: | CCOc1ccccc1NC(c1c2CCCCCc2sc1NC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7445 |
| logD: | 4.7302 |
| logSw: | -5.7293 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.979 |
| InChI Key: | XUAJHPNDCYXPNQ-UHFFFAOYSA-N |