methyl 4-[2-(6-chloro-1,1-dioxo-4-phenyl-1lambda~6~,2,3-benzothiadiazin-2(1H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(6-chloro-1,1-dioxo-4-phenyl-1lambda~6~,2,3-benzothiadiazin-2(1H)-yl)acetamido]benzoate
methyl 4-[2-(6-chloro-1,1-dioxo-4-phenyl-1lambda~6~,2,3-benzothiadiazin-2(1H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | G682-0137 |
| Compound Name: | methyl 4-[2-(6-chloro-1,1-dioxo-4-phenyl-1lambda~6~,2,3-benzothiadiazin-2(1H)-yl)acetamido]benzoate |
| Molecular Weight: | 483.93 |
| Molecular Formula: | C23 H18 Cl N3 O5 S |
| Smiles: | COC(c1ccc(cc1)NC(CN1N=C(c2ccccc2)c2cc(ccc2S1(=O)=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8014 |
| logD: | 4.8013 |
| logSw: | -4.8327 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.027 |
| InChI Key: | BGTFUMKMBFOKLN-UHFFFAOYSA-N |