4-(4-fluoro-2-methylphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
4-(4-fluoro-2-methylphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
4-(4-fluoro-2-methylphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0078 |
| Compound Name: | 4-(4-fluoro-2-methylphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 314.34 |
| Molecular Formula: | C16 H11 F N2 O2 S |
| Smiles: | Cc1cc(ccc1N1C=C(C#N)S(c2ccccc12)(=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 2.5549 |
| logD: | 2.5549 |
| logSw: | -2.6955 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.706 |
| InChI Key: | UFHLWGSLNVDDOX-UHFFFAOYSA-N |