N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-1-(4-methoxybenzoyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-1-(4-methoxybenzoyl)pyrrolidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-1-(4-methoxybenzoyl)pyrrolidine-3-carboxamide
Compound characteristics
Compound ID: | V026-9105 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-1-(4-methoxybenzoyl)pyrrolidine-3-carboxamide |
Molecular Weight: | 518.57 |
Molecular Formula: | C29 H30 N2 O7 |
Smiles: | COc1ccc(cc1)C(N1CC(C(C1)c1ccc(cc1OC)OC)C(NCc1ccc2c(c1)OCO2)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.4338 |
logD: | 3.4338 |
logSw: | -3.6389 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.095 |
InChI Key: | HYHOYWUPRARKSE-UHFFFAOYSA-N |