methyl 2-(3-fluorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(3-fluorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-(3-fluorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2043-3739 |
| Compound Name: | methyl 2-(3-fluorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 333.38 |
| Molecular Formula: | C17 H16 F N O3 S |
| Smiles: | COC(c1c2CCCCc2sc1NC(c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.88 |
| logD: | -0.6533 |
| logSw: | -4.3123 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.218 |
| InChI Key: | JOTHXCSYVNNPGB-UHFFFAOYSA-N |