N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Chemical Structure Depiction of
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Compound characteristics
| Compound ID: | K788-1986 |
| Compound Name: | N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide |
| Molecular Weight: | 610.7 |
| Molecular Formula: | C32 H33 F3 N4 O3 S |
| Smiles: | COc1ccc(cc1)N1CCN(CCCNC(CN2C(/C(=C/c3ccc(cc3)C(F)(F)F)Sc3ccccc23)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.3723 |
| logD: | 4.7862 |
| logSw: | -5.3286 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.169 |
| InChI Key: | ZDTSUPPQFMCDGN-UHFFFAOYSA-N |