ethyl 2-[2-(3-bromophenoxy)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(3-bromophenoxy)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
ethyl 2-[2-(3-bromophenoxy)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8010-5427 |
| Compound Name: | ethyl 2-[2-(3-bromophenoxy)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate |
| Molecular Weight: | 452.37 |
| Molecular Formula: | C20 H22 Br N O4 S |
| Smiles: | CCOC(c1c2CCCCCc2sc1NC(COc1cccc(c1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4091 |
| logD: | 3.2273 |
| logSw: | -5.329 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.415 |
| InChI Key: | OBVASXARULQIKO-UHFFFAOYSA-N |