7-bromo-3-chloro-N-(2-cyanocyclopent-1-en-1-yl)-4-(difluoromethoxy)-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
7-bromo-3-chloro-N-(2-cyanocyclopent-1-en-1-yl)-4-(difluoromethoxy)-1-benzothiophene-2-carboxamide
7-bromo-3-chloro-N-(2-cyanocyclopent-1-en-1-yl)-4-(difluoromethoxy)-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y500-4237 |
| Compound Name: | 7-bromo-3-chloro-N-(2-cyanocyclopent-1-en-1-yl)-4-(difluoromethoxy)-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 447.68 |
| Molecular Formula: | C16 H10 Br Cl F2 N2 O2 S |
| Smiles: | C1CC(C#N)=C(C1)NC(c1c(c2c(ccc(c2s1)[Br])OC(F)F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5999 |
| logD: | 4.1549 |
| logSw: | -4.8456 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.191 |
| InChI Key: | CTRQESOZNUTRIC-UHFFFAOYSA-N |