4-(2,5-diethoxyphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
4-(2,5-diethoxyphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
4-(2,5-diethoxyphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0125 |
| Compound Name: | 4-(2,5-diethoxyphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 388.42 |
| Molecular Formula: | C19 H17 F N2 O4 S |
| Smiles: | CCOc1ccc(c(c1)N1C=C(C#N)S(c2ccc(cc12)F)(=O)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.1528 |
| logD: | 3.1528 |
| logSw: | -3.4378 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.04 |
| InChI Key: | XMSCRYCORAYQGQ-UHFFFAOYSA-N |