ethyl 2-{3-[(4-chlorophenoxy)methyl]benzamido}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{3-[(4-chlorophenoxy)methyl]benzamido}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
ethyl 2-{3-[(4-chlorophenoxy)methyl]benzamido}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6228-2358 |
| Compound Name: | ethyl 2-{3-[(4-chlorophenoxy)methyl]benzamido}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate |
| Molecular Weight: | 484.01 |
| Molecular Formula: | C26 H26 Cl N O4 S |
| Smiles: | CCOC(c1c2CCCCCc2sc1NC(c1cccc(COc2ccc(cc2)[Cl])c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7088 |
| logD: | 2.5359 |
| logSw: | -6.4228 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.357 |
| InChI Key: | NNBXGZOASTXTKB-UHFFFAOYSA-N |