6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-2-methyl-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]-2-methyl-3-oxopropane-1-sulfonyl}-2-methyl-2H-1,4-benzothiazin-3(4H)-one
6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-2-methyl-3-oxopropane-1-sulfonyl}-2-methyl-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | E912-0567 |
| Compound Name: | 6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-2-methyl-3-oxopropane-1-sulfonyl}-2-methyl-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 491.6 |
| Molecular Formula: | C23 H26 F N3 O4 S2 |
| Smiles: | CC(CS(c1ccc2c(c1)NC(C(C)S2)=O)(=O)=O)C(N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7499 |
| logD: | 2.7499 |
| logSw: | -3.544 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.76 |
| InChI Key: | VWMBWHZMMKLQDV-UHFFFAOYSA-N |