ethyl 2-[2-(4-chloro-2-methylphenoxy)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(4-chloro-2-methylphenoxy)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
ethyl 2-[2-(4-chloro-2-methylphenoxy)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3772-3747 |
| Compound Name: | ethyl 2-[2-(4-chloro-2-methylphenoxy)acetamido]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate |
| Molecular Weight: | 421.94 |
| Molecular Formula: | C21 H24 Cl N O4 S |
| Smiles: | CCOC(c1c2CCCCCc2sc1NC(COc1ccc(cc1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1456 |
| logD: | 3.9637 |
| logSw: | -6.168 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.502 |
| InChI Key: | MNNXFISNLZIURP-UHFFFAOYSA-N |