7-fluoro-N-[(2-fluorophenyl)methyl]-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
Chemical Structure Depiction of
7-fluoro-N-[(2-fluorophenyl)methyl]-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
7-fluoro-N-[(2-fluorophenyl)methyl]-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide
Compound characteristics
Compound ID: | P563-1063 |
Compound Name: | 7-fluoro-N-[(2-fluorophenyl)methyl]-5,5-dioxo-1,2,3,5-tetrahydro-5lambda~6~-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide |
Molecular Weight: | 390.41 |
Molecular Formula: | C19 H16 F2 N2 O3 S |
Smiles: | C1CC2=C(C(NCc3ccccc3F)=O)S(c3cc(ccc3N2C1)F)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9625 |
logD: | 2.9624 |
logSw: | -3.5645 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.426 |
InChI Key: | HPXGKILQSHCBDP-UHFFFAOYSA-N |