2-(2-methylphenyl)-4-[(4-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
2-(2-methylphenyl)-4-[(4-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
2-(2-methylphenyl)-4-[(4-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
| Compound ID: | K261-2601 |
| Compound Name: | 2-(2-methylphenyl)-4-[(4-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
| Molecular Weight: | 423.45 |
| Molecular Formula: | C21 H17 N3 O5 S |
| Smiles: | Cc1ccccc1N1C(N(Cc2ccc(cc2)[N+]([O-])=O)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5485 |
| logD: | 4.5485 |
| logSw: | -4.3452 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.823 |
| InChI Key: | VQCORVGLGFAAFD-UHFFFAOYSA-N |