4-(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl) 1-tert-butyl piperidine-1,4-dicarboxylate
Chemical Structure Depiction of
4-(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl) 1-tert-butyl piperidine-1,4-dicarboxylate
4-(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl) 1-tert-butyl piperidine-1,4-dicarboxylate
Compound characteristics
| Compound ID: | IB05-6124 |
| Compound Name: | 4-(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl) 1-tert-butyl piperidine-1,4-dicarboxylate |
| Molecular Weight: | 491.58 |
| Molecular Formula: | C29 H33 N O6 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OC(C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.08 |
| logD: | 6.08 |
| logSw: | -6.98 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 119.99 |
| InChI Key: | BMUGYIDKVPNJGS-UHFFFAOYSA-N |