methyl 2-[2-(3,4-difluoroanilino)-2-oxoethyl]-1,1-dioxo-4-phenyl-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Chemical Structure Depiction of
methyl 2-[2-(3,4-difluoroanilino)-2-oxoethyl]-1,1-dioxo-4-phenyl-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
methyl 2-[2-(3,4-difluoroanilino)-2-oxoethyl]-1,1-dioxo-4-phenyl-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Compound characteristics
| Compound ID: | C200-5711 |
| Compound Name: | methyl 2-[2-(3,4-difluoroanilino)-2-oxoethyl]-1,1-dioxo-4-phenyl-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate |
| Molecular Weight: | 484.48 |
| Molecular Formula: | C24 H18 F2 N2 O5 S |
| Smiles: | COC(C1=C(c2ccccc2)c2ccccc2S(N1CC(Nc1ccc(c(c1)F)F)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5336 |
| logD: | 4.5296 |
| logSw: | -4.3618 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.724 |
| InChI Key: | ULJKPZYNYGEEOX-UHFFFAOYSA-N |