2-[(3-chlorophenyl)methylidene]-4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-[(3-chlorophenyl)methylidene]-4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
2-[(3-chlorophenyl)methylidene]-4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
Compound ID: | C312-0292 |
Compound Name: | 2-[(3-chlorophenyl)methylidene]-4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one |
Molecular Weight: | 441.98 |
Molecular Formula: | C23 H24 Cl N3 O2 S |
Smiles: | CCN1CCN(CC1)C(CN1C(/C(=C\c2cccc(c2)[Cl])Sc2ccccc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6808 |
logD: | 3.5046 |
logSw: | -3.9676 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 34.999 |
InChI Key: | VNMKVRYCHJMCBC-UHFFFAOYSA-N |