methyl 5-nitro-3-(2,3,3,3-tetrafluoro-2-methoxypropanamido)-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-nitro-3-(2,3,3,3-tetrafluoro-2-methoxypropanamido)-1-benzothiophene-2-carboxylate
methyl 5-nitro-3-(2,3,3,3-tetrafluoro-2-methoxypropanamido)-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8012-3538 |
| Compound Name: | methyl 5-nitro-3-(2,3,3,3-tetrafluoro-2-methoxypropanamido)-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 410.3 |
| Molecular Formula: | C14 H10 F4 N2 O6 S |
| Smiles: | COC(c1c(c2cc(ccc2s1)[N+]([O-])=O)NC(C(C(F)(F)F)(OC)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0887 |
| logD: | 1.5245 |
| logSw: | -3.4482 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.139 |
| InChI Key: | DGEOAACOOJUAPU-ZDUSSCGKSA-N |