N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-4-cyanobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-4-cyanobenzene-1-sulfonamide
N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-4-cyanobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L904-0300 |
| Compound Name: | N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-4-cyanobenzene-1-sulfonamide |
| Molecular Weight: | 425.91 |
| Molecular Formula: | C20 H12 Cl N3 O2 S2 |
| Smiles: | [H]c1ccc2c(c1)sc(c1ccc(cc1[Cl])NS(c1ccc(C#N)cc1)(=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.3568 |
| logD: | 5.037 |
| logSw: | -6.1865 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.393 |
| InChI Key: | KUAKICQVDSRRMZ-UHFFFAOYSA-N |