2-(2-benzylidene-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-(2-benzylidene-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide
2-(2-benzylidene-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide
Compound characteristics
Compound ID: | K788-1120 |
Compound Name: | 2-(2-benzylidene-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide |
Molecular Weight: | 450.6 |
Molecular Formula: | C25 H30 N4 O2 S |
Smiles: | CN1CCN(CCCNC(CN2C(/C(=C/c3ccccc3)Sc3ccccc23)=O)=O)CC1 |
Stereo: | ACHIRAL |
logP: | 2.5828 |
logD: | 1.3782 |
logSw: | -3.0265 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.842 |
InChI Key: | BBSLAUWNIUYLKO-UHFFFAOYSA-N |