2-({4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-({4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one
2-({4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
Compound ID: | K788-3030 |
Compound Name: | 2-({4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one |
Molecular Weight: | 459.54 |
Molecular Formula: | C26 H22 F N3 O2 S |
Smiles: | C1CN(CCN1C(c1ccc(\C=C2/C(Nc3ccccc3S2)=O)cc1)=O)c1ccc(cc1)F |
Stereo: | ACHIRAL |
logP: | 4.2457 |
logD: | 4.2457 |
logSw: | -4.275 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 44.753 |
InChI Key: | IGCWWHQTSMERBN-UHFFFAOYSA-N |