2-(3-fluoro-4-methylphenyl)-4-[(3-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
2-(3-fluoro-4-methylphenyl)-4-[(3-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
2-(3-fluoro-4-methylphenyl)-4-[(3-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
| Compound ID: | K261-2423 |
| Compound Name: | 2-(3-fluoro-4-methylphenyl)-4-[(3-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
| Molecular Weight: | 441.44 |
| Molecular Formula: | C21 H16 F N3 O5 S |
| Smiles: | Cc1ccc(cc1F)N1C(N(Cc2cccc(c2)[N+]([O-])=O)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7564 |
| logD: | 4.7564 |
| logSw: | -4.5782 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.124 |
| InChI Key: | XQUBWVMYUJJAOE-UHFFFAOYSA-N |