4-[3-(2,4-dimethylanilino)-2-oxopropyl]-2-phenyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
4-[3-(2,4-dimethylanilino)-2-oxopropyl]-2-phenyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
4-[3-(2,4-dimethylanilino)-2-oxopropyl]-2-phenyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
Compound ID: | K261-1057 |
Compound Name: | 4-[3-(2,4-dimethylanilino)-2-oxopropyl]-2-phenyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
Molecular Weight: | 449.53 |
Molecular Formula: | C24 H23 N3 O4 S |
Smiles: | Cc1ccc(c(C)c1)NCC(CN1C(N(c2ccccc2)S(c2ccccc12)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.182 |
logD: | 4.182 |
logSw: | -4.1712 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.306 |
InChI Key: | QGEUYIFDHXNXRI-UHFFFAOYSA-N |