methyl 3-chloro-6-(3-methylbenzamido)-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-chloro-6-(3-methylbenzamido)-1-benzothiophene-2-carboxylate
methyl 3-chloro-6-(3-methylbenzamido)-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y502-4142 |
| Compound Name: | methyl 3-chloro-6-(3-methylbenzamido)-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 359.83 |
| Molecular Formula: | C18 H14 Cl N O3 S |
| Smiles: | Cc1cccc(c1)C(Nc1ccc2c(c(C(=O)OC)sc2c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0726 |
| logD: | 5.0439 |
| logSw: | -5.4004 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.25 |
| InChI Key: | MYEKUWIBLZUSER-UHFFFAOYSA-N |