propyl 2-[2-(3,5-dimethylphenoxy)acetamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propyl 2-[2-(3,5-dimethylphenoxy)acetamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propyl 2-[2-(3,5-dimethylphenoxy)acetamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-5132 |
| Compound Name: | propyl 2-[2-(3,5-dimethylphenoxy)acetamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 415.55 |
| Molecular Formula: | C23 H29 N O4 S |
| Smiles: | CCCOC(c1c2CCC(C)Cc2sc1NC(COc1cc(C)cc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9757 |
| logD: | 3.7939 |
| logSw: | -5.5231 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.378 |
| InChI Key: | PVMZSTAOHAUHCS-CQSZACIVSA-N |