N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-1-(3-methoxybenzoyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-1-(3-methoxybenzoyl)pyrrolidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-1-(3-methoxybenzoyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | V026-9116 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-1-(3-methoxybenzoyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 518.57 |
| Molecular Formula: | C29 H30 N2 O7 |
| Smiles: | COc1cccc(c1)C(N1CC(C(C1)c1ccc(cc1OC)OC)C(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4295 |
| logD: | 3.4295 |
| logSw: | -3.6766 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.095 |
| InChI Key: | LQFKRDJINYBDTI-UHFFFAOYSA-N |