N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-cyanobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-cyanobenzene-1-sulfonamide
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-cyanobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L904-1732 |
| Compound Name: | N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-cyanobenzene-1-sulfonamide |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C21 H15 N3 O2 S2 |
| Smiles: | [H]c1ccc2c(c1)sc(c1ccc(c(C)c1)NS(c1cccc(C#N)c1)(=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.7253 |
| logD: | 4.7146 |
| logSw: | -4.614 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.695 |
| InChI Key: | NYMRFSRRCXMESC-UHFFFAOYSA-N |