2-benzoyl-4-(4-chlorophenyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
2-benzoyl-4-(4-chlorophenyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
2-benzoyl-4-(4-chlorophenyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
Compound ID: | C200-5857 |
Compound Name: | 2-benzoyl-4-(4-chlorophenyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
Molecular Weight: | 413.85 |
Molecular Formula: | C21 H13 Cl F N O3 S |
Smiles: | C1=C(C(c2ccccc2)=O)S(c2ccc(cc2N1c1ccc(cc1)[Cl])F)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.2294 |
logD: | 4.2294 |
logSw: | -4.6943 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 44.417 |
InChI Key: | YYNSYFQIQWURIN-UHFFFAOYSA-N |