6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropane-1-sulfonyl}-2-methyl-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropane-1-sulfonyl}-2-methyl-2H-1,4-benzothiazin-3(4H)-one
6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropane-1-sulfonyl}-2-methyl-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | E511-1407 |
| Compound Name: | 6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropane-1-sulfonyl}-2-methyl-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C22 H24 F N3 O4 S2 |
| Smiles: | CC1C(Nc2cc(ccc2S1)S(CCC(N1CCN(CC1)c1ccccc1F)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3275 |
| logD: | 2.3275 |
| logSw: | -3.03 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.233 |
| InChI Key: | VIZQXDUFCMPNNR-OAHLLOKOSA-N |