4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[3-(propylsulfanyl)propyl]benzamide
Chemical Structure Depiction of
4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[3-(propylsulfanyl)propyl]benzamide
4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[3-(propylsulfanyl)propyl]benzamide
Compound characteristics
| Compound ID: | K788-9575 |
| Compound Name: | 4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[3-(propylsulfanyl)propyl]benzamide |
| Molecular Weight: | 520.69 |
| Molecular Formula: | C29 H29 F N2 O2 S2 |
| Smiles: | CCCSCCCNC(c1ccc(\C=C2/C(N(Cc3ccccc3F)c3ccccc3S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1903 |
| logD: | 6.1903 |
| logSw: | -5.5591 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.596 |
| InChI Key: | DJTUVOHOSBIFGT-UHFFFAOYSA-N |