6-{4-[(3-fluorophenyl)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[(3-fluorophenyl)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzothiazol-2(3H)-one
6-{4-[(3-fluorophenyl)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0257 |
| Compound Name: | 6-{4-[(3-fluorophenyl)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 449.52 |
| Molecular Formula: | C20 H20 F N3 O4 S2 |
| Smiles: | CN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(Cc1cccc(c1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.999 |
| logD: | 2.999 |
| logSw: | -3.5178 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.488 |
| InChI Key: | TZWQXGBPXSZTSJ-UHFFFAOYSA-N |