2-[2-(5-chloro-2-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N,N-diethylacetamide
Chemical Structure Depiction of
2-[2-(5-chloro-2-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N,N-diethylacetamide
2-[2-(5-chloro-2-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N,N-diethylacetamide
Compound characteristics
Compound ID: | K261-2291 |
Compound Name: | 2-[2-(5-chloro-2-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N,N-diethylacetamide |
Molecular Weight: | 435.93 |
Molecular Formula: | C20 H22 Cl N3 O4 S |
Smiles: | CCN(CC)C(CN1C(N(c2cc(ccc2C)[Cl])S(c2ccccc12)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.5363 |
logD: | 3.5362 |
logSw: | -3.7321 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 62.118 |
InChI Key: | OBDCFXQPTBVFKW-UHFFFAOYSA-N |