ethyl 2-[2-(2,4-dichloro-6-methylphenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(2,4-dichloro-6-methylphenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[2-(2,4-dichloro-6-methylphenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
Compound ID: | 4321-0064 |
Compound Name: | ethyl 2-[2-(2,4-dichloro-6-methylphenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
Molecular Weight: | 442.36 |
Molecular Formula: | C20 H21 Cl2 N O4 S |
Smiles: | CCOC(c1c2CCCCc2sc1NC(COc1c(C)cc(cc1[Cl])[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 6.1224 |
logD: | 3.9406 |
logSw: | -6.4188 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.257 |
InChI Key: | YMYNRIHJBGGYQP-UHFFFAOYSA-N |