2-({2,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}sulfanyl)pyridine-3-carboxylic acid
Chemical Structure Depiction of
2-({2,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}sulfanyl)pyridine-3-carboxylic acid
2-({2,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}sulfanyl)pyridine-3-carboxylic acid
Compound characteristics
| Compound ID: | 4676-0659 |
| Compound Name: | 2-({2,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}sulfanyl)pyridine-3-carboxylic acid |
| Molecular Weight: | 396.34 |
| Molecular Formula: | C17 H11 F3 N2 O4 S |
| Smiles: | C1C(C(N(C1=O)c1cccc(c1)C(F)(F)F)=O)Sc1c(cccn1)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3486 |
| logD: | 0.2504 |
| logSw: | -2.797 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.745 |
| InChI Key: | DBBGNZNRWGZZSC-LBPRGKRZSA-N |