4-(4-chloro-2-methoxy-5-methylphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
4-(4-chloro-2-methoxy-5-methylphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
4-(4-chloro-2-methoxy-5-methylphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0191 |
| Compound Name: | 4-(4-chloro-2-methoxy-5-methylphenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 378.81 |
| Molecular Formula: | C17 H12 Cl F N2 O3 S |
| Smiles: | Cc1cc(c(cc1[Cl])OC)N1C=C(C#N)S(c2ccc(cc12)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6975 |
| logD: | 3.6975 |
| logSw: | -4.112 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.336 |
| InChI Key: | PRPCYGHCOQVLLW-UHFFFAOYSA-N |