4-(2,5-dimethoxyphenyl)-8-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
4-(2,5-dimethoxyphenyl)-8-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
4-(2,5-dimethoxyphenyl)-8-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0609 |
| Compound Name: | 4-(2,5-dimethoxyphenyl)-8-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 360.36 |
| Molecular Formula: | C17 H13 F N2 O4 S |
| Smiles: | COc1ccc(c(c1)N1C=C(C#N)S(c2c1cccc2F)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.197 |
| logD: | 2.197 |
| logSw: | -2.5486 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.88 |
| InChI Key: | XWJIRCFISDLKEQ-UHFFFAOYSA-N |