N-[3-(4-methylpiperidin-1-yl)propyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-[3-(4-methylpiperidin-1-yl)propyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
N-[3-(4-methylpiperidin-1-yl)propyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide
Compound characteristics
Compound ID: | K788-3037 |
Compound Name: | N-[3-(4-methylpiperidin-1-yl)propyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)methyl]benzamide |
Molecular Weight: | 435.59 |
Molecular Formula: | C25 H29 N3 O2 S |
Smiles: | CC1CCN(CCCNC(c2ccc(\C=C3/C(Nc4ccccc4S3)=O)cc2)=O)CC1 |
Stereo: | ACHIRAL |
logP: | 3.7377 |
logD: | 1.2774 |
logSw: | -3.8897 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 53.082 |
InChI Key: | RNERPXMAQYOYCZ-UHFFFAOYSA-N |