4-[2-(5-bromothiophen-2-yl)-2-oxoethyl]-2-(3-chlorophenyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
4-[2-(5-bromothiophen-2-yl)-2-oxoethyl]-2-(3-chlorophenyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
4-[2-(5-bromothiophen-2-yl)-2-oxoethyl]-2-(3-chlorophenyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
Compound ID: | K261-1371 |
Compound Name: | 4-[2-(5-bromothiophen-2-yl)-2-oxoethyl]-2-(3-chlorophenyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
Molecular Weight: | 511.8 |
Molecular Formula: | C19 H12 Br Cl N2 O4 S2 |
Smiles: | C(C(c1ccc(s1)[Br])=O)N1C(N(c2cccc(c2)[Cl])S(c2ccccc12)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.1201 |
logD: | 5.1201 |
logSw: | -5.4339 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 61.008 |
InChI Key: | DCNQAGYUFUWBOE-UHFFFAOYSA-N |