N-(3-chloro-4-fluorophenyl)-3-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]propanamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-3-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]propanamide
N-(3-chloro-4-fluorophenyl)-3-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]propanamide
Compound characteristics
| Compound ID: | F952-2085 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-3-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-3(2H)-yl]propanamide |
| Molecular Weight: | 483.97 |
| Molecular Formula: | C20 H19 Cl F N3 O4 S2 |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)SC(N2CCC(Nc1ccc(c(c1)[Cl])F)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2374 |
| logD: | 4.1785 |
| logSw: | -4.4902 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.016 |
| InChI Key: | DKIRALHABZAFAW-UHFFFAOYSA-N |