N-(4-bromophenyl)-2-(2-chlorobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-(2-chlorobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
N-(4-bromophenyl)-2-(2-chlorobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3261-0764 |
| Compound Name: | N-(4-bromophenyl)-2-(2-chlorobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 503.84 |
| Molecular Formula: | C23 H20 Br Cl N2 O2 S |
| Smiles: | C1CCc2c(C(Nc3ccc(cc3)[Br])=O)c(NC(c3ccccc3[Cl])=O)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 6.8268 |
| logD: | 4.8125 |
| logSw: | -6.4835 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.467 |
| InChI Key: | XTVAMUMZNGWHEW-UHFFFAOYSA-N |