ethyl 2-(3,4-dimethylbenzamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3,4-dimethylbenzamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(3,4-dimethylbenzamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-1028 |
| Compound Name: | ethyl 2-(3,4-dimethylbenzamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C21 H25 N O3 S |
| Smiles: | CCOC(c1c2CCC(C)Cc2sc1NC(c1ccc(C)c(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5594 |
| logD: | 1.2863 |
| logSw: | -5.4998 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.798 |
| InChI Key: | XYOZVZZWTBCKJP-GFCCVEGCSA-N |