4-[(3-bromophenyl)methyl]-2-[4-(propan-2-yl)phenyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
4-[(3-bromophenyl)methyl]-2-[4-(propan-2-yl)phenyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
4-[(3-bromophenyl)methyl]-2-[4-(propan-2-yl)phenyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
| Compound ID: | K261-2888 |
| Compound Name: | 4-[(3-bromophenyl)methyl]-2-[4-(propan-2-yl)phenyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
| Molecular Weight: | 485.4 |
| Molecular Formula: | C23 H21 Br N2 O3 S |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(Cc2cccc(c2)[Br])c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3038 |
| logD: | 6.3038 |
| logSw: | -5.4519 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.743 |
| InChI Key: | YXGYLPZBVOOYDB-UHFFFAOYSA-N |