6-[4-(2-fluorophenyl)piperazine-1-sulfonyl]-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(2-fluorophenyl)piperazine-1-sulfonyl]-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,3-benzothiazol-2(3H)-one
6-[4-(2-fluorophenyl)piperazine-1-sulfonyl]-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F952-0177 |
| Compound Name: | 6-[4-(2-fluorophenyl)piperazine-1-sulfonyl]-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 518.63 |
| Molecular Formula: | C24 H27 F N4 O4 S2 |
| Smiles: | C1CCN(C1)C(CCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)c1ccccc1F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6652 |
| logD: | 3.6652 |
| logSw: | -4.0555 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.218 |
| InChI Key: | KUNJIJXRQWZZTL-UHFFFAOYSA-N |