2-[(4-methoxyphenyl)methyl]-4-[(3-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
2-[(4-methoxyphenyl)methyl]-4-[(3-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
2-[(4-methoxyphenyl)methyl]-4-[(3-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
| Compound ID: | K261-2144 |
| Compound Name: | 2-[(4-methoxyphenyl)methyl]-4-[(3-nitrophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
| Molecular Weight: | 453.47 |
| Molecular Formula: | C22 H19 N3 O6 S |
| Smiles: | COc1ccc(CN2C(N(Cc3cccc(c3)[N+]([O-])=O)c3ccccc3S2(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0183 |
| logD: | 4.0183 |
| logSw: | -4.2292 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.884 |
| InChI Key: | RTSNIXYECDGPQB-UHFFFAOYSA-N |