1-(2H-1,3-benzodioxole-5-carbonyl)-4-(4-methylphenyl)-N-(2-methylpropyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
1-(2H-1,3-benzodioxole-5-carbonyl)-4-(4-methylphenyl)-N-(2-methylpropyl)pyrrolidine-3-carboxamide
1-(2H-1,3-benzodioxole-5-carbonyl)-4-(4-methylphenyl)-N-(2-methylpropyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | V028-2773 |
| Compound Name: | 1-(2H-1,3-benzodioxole-5-carbonyl)-4-(4-methylphenyl)-N-(2-methylpropyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 408.5 |
| Molecular Formula: | C24 H28 N2 O4 |
| Smiles: | CC(C)CNC(C1CN(CC1c1ccc(C)cc1)C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6741 |
| logD: | 3.6741 |
| logSw: | -3.8232 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.648 |
| InChI Key: | QAEBPEDLTFWLCB-UHFFFAOYSA-N |