methyl 4-chloro-3-{2-[3-(trifluoromethyl)benzene-1-sulfonyl]acetamido}-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 4-chloro-3-{2-[3-(trifluoromethyl)benzene-1-sulfonyl]acetamido}-1-benzothiophene-2-carboxylate
methyl 4-chloro-3-{2-[3-(trifluoromethyl)benzene-1-sulfonyl]acetamido}-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | C200-6220 |
| Compound Name: | methyl 4-chloro-3-{2-[3-(trifluoromethyl)benzene-1-sulfonyl]acetamido}-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 491.89 |
| Molecular Formula: | C19 H13 Cl F3 N O5 S2 |
| Smiles: | COC(c1c(c2c(cccc2s1)[Cl])NC(CS(c1cccc(c1)C(F)(F)F)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.09 |
| logD: | 3.7334 |
| logSw: | -4.373 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.677 |
| InChI Key: | AISHJSMXVWGKKU-UHFFFAOYSA-N |