2-[2-(3-chlorophenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[2-(3-chlorophenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
2-[2-(3-chlorophenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
Compound characteristics
Compound ID: | K261-3125 |
Compound Name: | 2-[2-(3-chlorophenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide |
Molecular Weight: | 515.97 |
Molecular Formula: | C24 H22 Cl N3 O6 S |
Smiles: | COc1cccc(CNC(CN2C(N(c3cccc(c3)[Cl])S(c3ccccc23)(=O)=O)=O)=O)c1OC |
Stereo: | ACHIRAL |
logP: | 3.9971 |
logD: | 3.9971 |
logSw: | -4.316 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 86.562 |
InChI Key: | BUSFBFLKWPYSMY-UHFFFAOYSA-N |