methyl 4-(3-cyanophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Chemical Structure Depiction of
methyl 4-(3-cyanophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
methyl 4-(3-cyanophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | G917-0264 |
| Compound Name: | methyl 4-(3-cyanophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 340.36 |
| Molecular Formula: | C17 H12 N2 O4 S |
| Smiles: | COC(C1=CN(c2cccc(C#N)c2)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6597 |
| logD: | 1.6597 |
| logSw: | -2.3415 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.18 |
| InChI Key: | JGYVSTCTCRVNIK-UHFFFAOYSA-N |