2-(cyclohexylamino)-2-oxoethyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
Chemical Structure Depiction of
2-(cyclohexylamino)-2-oxoethyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
2-(cyclohexylamino)-2-oxoethyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
Compound characteristics
| Compound ID: | F475-0382 |
| Compound Name: | 2-(cyclohexylamino)-2-oxoethyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate |
| Molecular Weight: | 511.52 |
| Molecular Formula: | C23 H24 F3 N3 O5 S |
| Smiles: | C1CCC(CC1)NC(COC(c1ccc(cc1)C1Nc2cc(ccc2S(N1)(=O)=O)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8673 |
| logD: | 3.8672 |
| logSw: | -4.0607 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.155 |
| InChI Key: | YYCXTMHMBGHQLY-NRFANRHFSA-N |