6-[4-(3-fluoro-4-methylbenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(3-fluoro-4-methylbenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
6-[4-(3-fluoro-4-methylbenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0291 |
| Compound Name: | 6-[4-(3-fluoro-4-methylbenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 449.52 |
| Molecular Formula: | C20 H20 F N3 O4 S2 |
| Smiles: | Cc1ccc(cc1F)C(N1CCN(CC1)S(c1ccc2c(c1)SC(N2C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1375 |
| logD: | 3.1375 |
| logSw: | -3.3598 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.016 |
| InChI Key: | WSMIGKXQXUOKIA-UHFFFAOYSA-N |