2-({1-[4-(difluoromethoxy)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
Chemical Structure Depiction of
2-({1-[4-(difluoromethoxy)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
2-({1-[4-(difluoromethoxy)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
Compound characteristics
| Compound ID: | 4676-1101 |
| Compound Name: | 2-({1-[4-(difluoromethoxy)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid |
| Molecular Weight: | 393.36 |
| Molecular Formula: | C18 H13 F2 N O5 S |
| Smiles: | C1C(C(N(C1=O)c1ccc(cc1)OC(F)F)=O)Sc1ccccc1C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2884 |
| logD: | -0.3229 |
| logSw: | -2.7316 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.171 |
| InChI Key: | FVUNDMKBSBSVJL-AWEZNQCLSA-N |