diethyl [(1-benzyl-1H-benzimidazol-2-yl)(hydroxy)methyl]propanedioate
Chemical Structure Depiction of
diethyl [(1-benzyl-1H-benzimidazol-2-yl)(hydroxy)methyl]propanedioate
diethyl [(1-benzyl-1H-benzimidazol-2-yl)(hydroxy)methyl]propanedioate
Compound characteristics
Compound ID: | D078-0004 |
Compound Name: | diethyl [(1-benzyl-1H-benzimidazol-2-yl)(hydroxy)methyl]propanedioate |
Molecular Weight: | 396.44 |
Molecular Formula: | C22 H24 N2 O5 |
Smiles: | CCOC(C(C(c1nc2ccccc2n1Cc1ccccc1)O)C(=O)OCC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.4294 |
logD: | 3.3219 |
logSw: | -3.2518 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.359 |
InChI Key: | LOEUETHKUFKDNP-IBGZPJMESA-N |