6-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methyl-3-oxopropane-1-sulfonyl}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methyl-3-oxopropane-1-sulfonyl}-2H-1,4-benzothiazin-3(4H)-one
6-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methyl-3-oxopropane-1-sulfonyl}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | E912-0685 |
| Compound Name: | 6-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methyl-3-oxopropane-1-sulfonyl}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 489.61 |
| Molecular Formula: | C23 H27 N3 O5 S2 |
| Smiles: | CC(CS(c1ccc2c(c1)NC(CS2)=O)(=O)=O)C(N1CCN(CC1)c1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.751 |
| logD: | 1.7507 |
| logSw: | -2.6195 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.334 |
| InChI Key: | RCYPHBDDHUHVFV-INIZCTEOSA-N |