dimethyl 2-({2-[5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-1-yl]ethyl}carbamamido)benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-({2-[5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-1-yl]ethyl}carbamamido)benzene-1,4-dicarboxylate
dimethyl 2-({2-[5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-1-yl]ethyl}carbamamido)benzene-1,4-dicarboxylate
Compound characteristics
Compound ID: | G373-3782 |
Compound Name: | dimethyl 2-({2-[5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-1-yl]ethyl}carbamamido)benzene-1,4-dicarboxylate |
Molecular Weight: | 493.52 |
Molecular Formula: | C25 H27 N5 O6 |
Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(NCCn1cnc2cc(ccc12)C(N1CCCC1)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.908 |
logD: | 1.8939 |
logSw: | -2.8344 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 102.804 |
InChI Key: | LVBMQFVMVGJQCD-UHFFFAOYSA-N |