2-{1-[4-(3-methoxyphenyl)piperazin-1-yl]-1-oxobutan-2-yl}-1,2-benzothiazol-3(2H)-one
Chemical Structure Depiction of
2-{1-[4-(3-methoxyphenyl)piperazin-1-yl]-1-oxobutan-2-yl}-1,2-benzothiazol-3(2H)-one
2-{1-[4-(3-methoxyphenyl)piperazin-1-yl]-1-oxobutan-2-yl}-1,2-benzothiazol-3(2H)-one
Compound characteristics
Compound ID: | E022-0924 |
Compound Name: | 2-{1-[4-(3-methoxyphenyl)piperazin-1-yl]-1-oxobutan-2-yl}-1,2-benzothiazol-3(2H)-one |
Molecular Weight: | 411.52 |
Molecular Formula: | C22 H25 N3 O3 S |
Smiles: | CCC(C(N1CCN(CC1)c1cccc(c1)OC)=O)N1C(c2ccccc2S1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6166 |
logD: | 3.6165 |
logSw: | -3.8004 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 43.837 |
InChI Key: | OZCNITMSBFXMEO-IBGZPJMESA-N |