dimethyl 2-({2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethyl}carbamamido)benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-({2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethyl}carbamamido)benzene-1,4-dicarboxylate
dimethyl 2-({2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethyl}carbamamido)benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | F120-0286 |
| Compound Name: | dimethyl 2-({2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethyl}carbamamido)benzene-1,4-dicarboxylate |
| Molecular Weight: | 464.4 |
| Molecular Formula: | C21 H19 F3 N4 O5 |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(NCCn1c2ccccc2nc1C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.885 |
| logD: | 3.8734 |
| logSw: | -4.0213 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.534 |
| InChI Key: | LHRCWBOVUDEJQU-UHFFFAOYSA-N |