3-chloro-N-[(3,4-dimethoxyphenyl)methyl]-4-fluoro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[(3,4-dimethoxyphenyl)methyl]-4-fluoro-1-benzothiophene-2-carboxamide
3-chloro-N-[(3,4-dimethoxyphenyl)methyl]-4-fluoro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y200-3891 |
| Compound Name: | 3-chloro-N-[(3,4-dimethoxyphenyl)methyl]-4-fluoro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 379.84 |
| Molecular Formula: | C18 H15 Cl F N O3 S |
| Smiles: | COc1ccc(CNC(c2c(c3c(cccc3s2)F)[Cl])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.2342 |
| logD: | 4.2342 |
| logSw: | -4.6939 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.659 |
| InChI Key: | MISNBQJXUGVXMZ-UHFFFAOYSA-N |