2-(1H-benzimidazol-2-yl)-3-[4-(4-chlorobenzene-1-sulfonyl)phenyl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-[4-(4-chlorobenzene-1-sulfonyl)phenyl]prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-[4-(4-chlorobenzene-1-sulfonyl)phenyl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 8010-6074 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-[4-(4-chlorobenzene-1-sulfonyl)phenyl]prop-2-enenitrile |
| Molecular Weight: | 419.89 |
| Molecular Formula: | C22 H14 Cl N3 O2 S |
| Smiles: | C(=C(C#N)/c1nc2ccccc2[nH]1)\c1ccc(cc1)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2444 |
| logD: | 5.2435 |
| logSw: | -6.0957 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.815 |
| InChI Key: | YMVQUSJCSQGUHD-UHFFFAOYSA-N |