N-{3-[cyclohexyl(methyl)amino]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-{3-[cyclohexyl(methyl)amino]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
N-{3-[cyclohexyl(methyl)amino]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Compound characteristics
Compound ID: | K788-3183 |
Compound Name: | N-{3-[cyclohexyl(methyl)amino]propyl}-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide |
Molecular Weight: | 449.61 |
Molecular Formula: | C26 H31 N3 O2 S |
Smiles: | CN(CCCNC(c1ccc(\C=C2/C(Nc3ccccc3S2)=O)cc1)=O)C1CCCCC1 |
Stereo: | ACHIRAL |
logP: | 4.0943 |
logD: | 1.5695 |
logSw: | -3.9862 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 52.137 |
InChI Key: | WXVGVIICPOGGPE-UHFFFAOYSA-N |