2-benzylidene-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-benzylidene-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
2-benzylidene-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
Compound ID: | K788-9530 |
Compound Name: | 2-benzylidene-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one |
Molecular Weight: | 442.54 |
Molecular Formula: | C25 H22 N4 O2 S |
Smiles: | C1CN(CCN1C(c1ccc2c(c1)NC(/C(=C/c1ccccc1)S2)=O)=O)c1ccccn1 |
Stereo: | ACHIRAL |
logP: | 4.2149 |
logD: | 4.2061 |
logSw: | -4.3261 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.264 |
InChI Key: | OKFLRVCGVBLCQO-UHFFFAOYSA-N |