methyl 6-methyl-2-(4-methylbenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 6-methyl-2-(4-methylbenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 6-methyl-2-(4-methylbenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2798-0819 |
| Compound Name: | methyl 6-methyl-2-(4-methylbenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 343.44 |
| Molecular Formula: | C19 H21 N O3 S |
| Smiles: | CC1CCc2c(C(=O)OC)c(NC(c3ccc(C)cc3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6146 |
| logD: | 0.8794 |
| logSw: | -4.5783 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.218 |
| InChI Key: | KXISAQHOTBGMMH-GFCCVEGCSA-N |