methyl 3-(3,5-dimethylbenzamido)-4,5-dihydrothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(3,5-dimethylbenzamido)-4,5-dihydrothiophene-2-carboxylate
methyl 3-(3,5-dimethylbenzamido)-4,5-dihydrothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 2513-1263 |
| Compound Name: | methyl 3-(3,5-dimethylbenzamido)-4,5-dihydrothiophene-2-carboxylate |
| Molecular Weight: | 291.37 |
| Molecular Formula: | C15 H17 N O3 S |
| Smiles: | Cc1cc(C)cc(c1)C(NC1CCSC=1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7875 |
| logD: | -1.021 |
| logSw: | -3.1973 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.871 |
| InChI Key: | MSLUDEHHKMPLHZ-UHFFFAOYSA-N |