methyl 4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoate
methyl 4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoate
Compound characteristics
| Compound ID: | K783-5531 |
| Compound Name: | methyl 4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoate |
| Molecular Weight: | 419.47 |
| Molecular Formula: | C24 H18 F N O3 S |
| Smiles: | COC(c1ccc(\C=C2/C(N(Cc3ccccc3F)c3ccccc3S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.876 |
| logD: | 5.876 |
| logSw: | -5.633 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.243 |
| InChI Key: | YIUUAKMFESJYBJ-UHFFFAOYSA-N |