1-(4-chloro-3-methoxybenzene-1-sulfonyl)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1H-benzimidazol-2-yl 4-chloro-3-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
1-(4-chloro-3-methoxybenzene-1-sulfonyl)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1H-benzimidazol-2-yl 4-chloro-3-methoxybenzene-1-sulfonate
1-(4-chloro-3-methoxybenzene-1-sulfonyl)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1H-benzimidazol-2-yl 4-chloro-3-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | 8012-9916 |
| Compound Name: | 1-(4-chloro-3-methoxybenzene-1-sulfonyl)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1H-benzimidazol-2-yl 4-chloro-3-methoxybenzene-1-sulfonate |
| Molecular Weight: | 689.51 |
| Molecular Formula: | C28 H21 Cl2 F3 N2 O7 S2 |
| Smiles: | COc1cc(ccc1[Cl])S(N1c2ccccc2NC1(c1ccc(cc1)C(F)(F)F)OS(c1ccc(c(c1)OC)[Cl])(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0322 |
| logD: | 7.0322 |
| logSw: | -6.6438 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.742 |
| InChI Key: | LXLBGMZSUBWFJD-NDEPHWFRSA-N |