1-(3-{[4-chloro-2-(trifluoromethyl)phenyl]carbamoyl}-4-fluorobenzene-1-sulfonyl)piperidine-4-carboxylic acid
Chemical Structure Depiction of
1-(3-{[4-chloro-2-(trifluoromethyl)phenyl]carbamoyl}-4-fluorobenzene-1-sulfonyl)piperidine-4-carboxylic acid
1-(3-{[4-chloro-2-(trifluoromethyl)phenyl]carbamoyl}-4-fluorobenzene-1-sulfonyl)piperidine-4-carboxylic acid
Compound characteristics
| Compound ID: | K781-8480 |
| Compound Name: | 1-(3-{[4-chloro-2-(trifluoromethyl)phenyl]carbamoyl}-4-fluorobenzene-1-sulfonyl)piperidine-4-carboxylic acid |
| Molecular Weight: | 508.87 |
| Molecular Formula: | C20 H17 Cl F4 N2 O5 S |
| Smiles: | C1CN(CCC1C(O)=O)S(c1ccc(c(c1)C(Nc1ccc(cc1C(F)(F)F)[Cl])=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5884 |
| logD: | 1.0281 |
| logSw: | -4.0005 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.751 |
| InChI Key: | RERMARFCUQWJLW-UHFFFAOYSA-N |