methyl 2-{[1,1,1,3,3,3-hexafluoro-2-(2-fluorobenzamido)propan-2-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[1,1,1,3,3,3-hexafluoro-2-(2-fluorobenzamido)propan-2-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-{[1,1,1,3,3,3-hexafluoro-2-(2-fluorobenzamido)propan-2-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8010-4310 |
| Compound Name: | methyl 2-{[1,1,1,3,3,3-hexafluoro-2-(2-fluorobenzamido)propan-2-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 498.42 |
| Molecular Formula: | C20 H17 F7 N2 O3 S |
| Smiles: | COC(c1c2CCCCc2sc1NC(C(F)(F)F)(C(F)(F)F)NC(c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3344 |
| logD: | -0.6123 |
| logSw: | -5.3324 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.416 |
| InChI Key: | YJBDRABVHYZHRQ-UHFFFAOYSA-N |