3-(4-bromobenzene-1-sulfonyl)-N-(6-cyano-2H-1,3-benzodioxol-5-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
3-(4-bromobenzene-1-sulfonyl)-N-(6-cyano-2H-1,3-benzodioxol-5-yl)benzene-1-sulfonamide
3-(4-bromobenzene-1-sulfonyl)-N-(6-cyano-2H-1,3-benzodioxol-5-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8015-4347 |
| Compound Name: | 3-(4-bromobenzene-1-sulfonyl)-N-(6-cyano-2H-1,3-benzodioxol-5-yl)benzene-1-sulfonamide |
| Molecular Weight: | 521.36 |
| Molecular Formula: | C20 H13 Br N2 O6 S2 |
| Smiles: | C1Oc2cc(C#N)c(cc2O1)NS(c1cccc(c1)S(c1ccc(cc1)[Br])(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3669 |
| logD: | 1.7375 |
| logSw: | -4.3591 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.863 |
| InChI Key: | KJTCKDSDJGZTOS-UHFFFAOYSA-N |